trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-7-[[(6Z)-6-[(2-methoxyphenyl)hydrazinylidene]-5-oxidanylidene-7-sulfonato-naphthalen-2-yl]carbamoylamino]-4-oxidanylidene-3-[(6-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate

Systemtic Name: trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-7-[[(6Z)-6-[(2-methoxyphenyl)hydrazinylidene]-5-oxidanylidene-7-sulfonato-naphthalen-2-yl]carbamoylamino]-4-oxidanylidene-3-[(6-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate Openeye Name: trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-7-[[(6Z)-6-[(2-methoxyphenyl)hydrazono]-5-oxo-7-sulfonato-2-naphthyl]carbamoylamino]-4-oxo-3-[(6-sulfonato-2-naphthyl)hydrazono]naphthalene-2-sulfonate CAS Name: trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-7-[[[[(6Z)-6-[(2-methoxyphenyl)hydrazinylidene]-5-oxo-7-sulfonato-2-naphthalenyl]amino]-oxomethyl]amino]-4-oxo-3-[(6-sulfonato-2-naphthalenyl)hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-7-[[(6Z)-6-[(2-methoxyphenyl)hydrazinylidene]-5-oxo-7-sulfonatonaphthalen-2-yl]carbamoylamino]-4-oxo-3-[(6-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate Traditional Name: trisodium; 2-[2-hydroxyethyl(methyl)amino]ethanol; (3E)-4-keto-7-[[(6Z)-5-keto-6-[(2-methoxyphenyl)hydrazono]-7-sulfonato-2-naphthyl]carbamoylamino]-3-[(6-sulfonato-2-naphthyl)hydrazono]naphthalene-2-sulfonate Formula: C43H38N7Na3O15S3 MolecularWeight: 1057.96403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)CCO.COC1=CC=CC=C1NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CN(CCO)CCO.COC1=CC=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C38H28N6O13S3.C5H13NO2.3Na/c1-57-31-5-3-2-4-30(31)42-44-35-33(60(54,55)56)19-23-16-25(10-13-29(23)37(35)46)40-38(47)39-24-9-12-28-22(15-24)18-32(59(51,52)53)34(36(28)45)43-41-26-8-6-21-17-27(58(48,49)50)11-7-20(21)14-26;1-6(2-4-7)3-5-8;;;/h2-19,41-42H,1H3,(H2,39,40,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);7-8H,2-5H2,1H3;;;/q;;3*+1/p-3/b43-34-,44-35+;;;;