8-oxidanylidene-7-[[2-oxidanyl-4-[3-oxidanyl-4-[2-(1-oxidanylidene-6-phenylazanyl-3-sulfonato-naphthalen-2-ylidene)hydrazinyl]phenyl]phenyl]hydrazinylidene]naphthalene-1,6-disulfonate

Systemtic Name: 8-oxidanylidene-7-[[2-oxidanyl-4-[3-oxidanyl-4-[2-(1-oxidanylidene-6-phenylazanyl-3-sulfonato-naphthalen-2-ylidene)hydrazinyl]phenyl]phenyl]hydrazinylidene]naphthalene-1,6-disulfonate Openeye Name: 7-[[4-[4-[2-(6-anilino-1-oxo-3-sulfonato-2-naphthylidene)hydrazino]-3-hydroxy-phenyl]-2-hydroxy-phenyl]hydrazono]-8-oxo-naphthalene-1,6-disulfonate CAS Name: 7-[[4-[4-[2-(6-anilino-1-oxo-3-sulfonato-2-naphthalenylidene)hydrazinyl]-3-hydroxyphenyl]-2-hydroxyphenyl]hydrazinylidene]-8-oxonaphthalene-1,6-disulfonate IUPAC Name: 7-[[4-[4-[2-(6-anilino-1-oxo-3-sulfonatonaphthalen-2-ylidene)hydrazinyl]-3-hydroxyphenyl]-2-hydroxyphenyl]hydrazinylidene]-8-oxonaphthalene-1,6-disulfonate Traditional Name: 7-[[4-[4-[N'-(6-anilino-1-keto-3-sulfonato-2-naphthylidene)hydrazino]-3-hydroxy-phenyl]-2-hydroxy-phenyl]hydrazono]-8-keto-naphthalene-1,6-disulfonate Formula: C38H24N5O13S3-3 MolecularWeight: 854.81786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)C(=NNC4=C(C=C(C=C4)C5=CC(=C(C=C5)NN=C6C(=CC7=C(C6=O)C(=CC=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])O)O)C(=C3)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)C(=NNC4=C(C=C(C=C4)C5=CC(=C(C=C5)NN=C6C(=CC7=C(C6=O)C(=CC=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])O)O)C(=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C38H27N5O13S3/c44-29-16-20(9-13-27(29)40-42-35-33(59(54,55)56)19-23-15-25(11-12-26(23)37(35)46)39-24-6-2-1-3-7-24)21-10-14-28(30(45)17-21)41-43-36-32(58(51,52)53)18-22-5-4-8-31(57(48,49)50)34(22)38(36)47/h1-19,39-41,44-45H,(H,48,49,50)(H,51,52,53)(H,54,55,56)/p-3