trisodium 4-oxidanylidene-5-[2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]-3-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-2,7-disulfonate

Systemtic Name: trisodium 4-oxidanylidene-5-[2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]-3-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-2,7-disulfonate Openeye Name: trisodium 4-oxo-5-[2-(2-oxo-1-naphthylidene)hydrazino]-3-[(4-sulfonato-1-naphthyl)hydrazono]naphthalene-2,7-disulfonate CAS Name: trisodium 4-oxo-5-[2-(2-oxo-1-naphthalenylidene)hydrazinyl]-3-[(4-sulfonato-1-naphthalenyl)hydrazinylidene]naphthalene-2,7-disulfonate IUPAC Name: trisodium 4-oxo-5-[2-(2-oxonaphthalen-1-ylidene)hydrazinyl]-3-[(4-sulfonatonaphthalen-1-yl)hydrazinylidene]naphthalene-2,7-disulfonate Traditional Name: trisodium 4-keto-5-[N'-(2-keto-1-naphthylidene)hydrazino]-3-[(4-sulfonato-1-naphthyl)hydrazono]naphthalene-2,7-disulfonate Formula: C30H17N4Na3O11S3 MolecularWeight: 774.64049

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=NNC5=CC=C(C6=CC=CC=C65)S(=O)(=O)[O-])C4=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=NNC5=CC=C(C6=CC=CC=C65)S(=O)(=O)[O-])C4=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C30H20N4O11S3.3Na/c35-24-11-9-16-5-1-2-6-19(16)28(24)33-32-23-15-18(46(37,38)39)13-17-14-26(48(43,44)45)29(30(36)27(17)23)34-31-22-10-12-25(47(40,41)42)21-8-4-3-7-20(21)22;;;/h1-15,31-32H,(H,37,38,39)(H,40,41,42)(H,43,44,45);;;/q;3*+1/p-3