trisodium (3Z)-6-[(2Z)-2-(4-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-[[4-[4-[(2E)-2-[7-[(2E)-2-(4-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1-oxidanylidene-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]-3-methyl-phenyl]-2-methyl-phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: trisodium (3Z)-6-[(2Z)-2-(4-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-[[4-[4-[(2E)-2-[7-[(2E)-2-(4-azanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1-oxidanylidene-3-sulfonato-naphthalen-2-ylidene]hydrazinyl]-3-methyl-phenyl]-2-methyl-phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: trisodium (3Z)-6-[(2Z)-2-(4-amino-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-3-[[4-[4-[(2E)-2-[7-[(2E)-2-(4-amino-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]-1-oxo-3-sulfonato-2-naphthylidene]hydrazino]-3-methyl-phenyl]-2-methyl-phenyl]hydrazono]-4-oxo-naphthalene-2,7-disulfonate CAS Name: trisodium (3Z)-6-[(2Z)-2-(4-amino-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-3-[[4-[4-[(2E)-2-[7-[(2E)-2-(4-amino-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]-1-oxo-3-sulfonato-2-naphthalenylidene]hydrazinyl]-3-methylphenyl]-2-methylphenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate IUPAC Name: trisodium (3Z)-6-[(2Z)-2-(4-amino-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-3-[[4-[4-[(2E)-2-[7-[(2E)-2-(4-amino-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-1-oxo-3-sulfonatonaphthalen-2-ylidene]hydrazinyl]-3-methylphenyl]-2-methylphenyl]hydrazinylidene]-4-oxonaphthalene-2,7-disulfonate Traditional Name: trisodium (3Z)-6-[(N'Z)-N'-(4-amino-6-keto-cyclohexa-2,4-dien-1-ylidene)hydrazino]-3-[[4-[4-[(N'E)-N'-[7-[(N'E)-N'-(4-amino-6-keto-cyclohexa-2,4-dien-1-ylidene)hydrazino]-1-keto-3-sulfonato-2-naphthylidene]hydrazino]-3-methyl-phenyl]-2-methyl-phenyl]hydrazono]-4-keto-naphthalene-2,7-disulfonate Formula: C46H33N10Na3O13S3 MolecularWeight: 1098.97773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NN=C3C(=CC4=CC(=C(C=C4C3=O)NN=C5C=CC(=CC5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)NN=C6C(=CC7=C(C6=O)C=C(C=C7)NN=C8C=CC(=CC8=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=CC(=C(C=C4C3=O)N/N=C\5/C=CC(=CC5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N/N=C\6/C(=CC7=C(C6=O)C=C(C=C7)N/N=C/8\C=CC(=CC8=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C46H36N10O13S3.3Na/c1-22-13-24(4-9-33(22)50-55-43-41(71(64,65)66)15-26-3-8-30(20-31(26)45(43)59)49-52-35-11-6-28(47)18-38(35)57)25-5-10-34(23(2)14-25)51-56-44-42(72(67,68)69)17-27-16-40(70(61,62)63)37(21-32(27)46(44)60)54-53-36-12-7-29(48)19-39(36)58;;;/h3-21,49-51,54H,47-48H2,1-2H3,(H,61,62,63)(H,64,65,66)(H,67,68,69);;;/q;3*+1/p-3/b52-35+,53-36-,55-43-,56-44+;;;