4-oxidanylidene-7-[[5-oxidanylidene-7-sulfo-6-[(6-sulfonaphthalen-2-yl)hydrazinylidene]naphthalen-2-yl]carbamoylamino]-3-(phenylhydrazinylidene)naphthalene-2-sulfonic acid; sodium

Systemtic Name: 4-oxidanylidene-7-[[5-oxidanylidene-7-sulfo-6-[(6-sulfonaphthalen-2-yl)hydrazinylidene]naphthalen-2-yl]carbamoylamino]-3-(phenylhydrazinylidene)naphthalene-2-sulfonic acid; sodium Openeye Name: 4-oxo-7-[[5-oxo-7-sulfo-6-[(6-sulfo-2-naphthyl)hydrazono]-2-naphthyl]carbamoylamino]-3-(phenylhydrazono)naphthalene-2-sulfonic acid; sodium CAS Name: 4-oxo-7-[[oxo-[[5-oxo-7-sulfo-6-[(6-sulfo-2-naphthalenyl)hydrazinylidene]-2-naphthalenyl]amino]methyl]amino]-3-(phenylhydrazinylidene)-2-naphthalenesulfonic acid; sodium IUPAC Name: 4-oxo-7-[[5-oxo-7-sulfo-6-[(6-sulfonaphthalen-2-yl)hydrazinylidene]naphthalen-2-yl]carbamoylamino]-3-(phenylhydrazinylidene)naphthalene-2-sulfonic acid; sodium Traditional Name: 4-keto-7-[[5-keto-7-sulfo-6-[(6-sulfo-2-naphthyl)hydrazono]-2-naphthyl]carbamoylamino]-3-(phenylhydrazono)naphthalene-2-sulfonic acid; sodium Formula: C37H26N6NaO12S3 MolecularWeight: 865.82011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=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]

Isomeric SMILES

C1=CC=C(C=C1)NN=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]

InChI

InChI=1S/C37H26N6O12S3.Na/c44-35-29-12-9-25(15-22(29)18-31(57(50,51)52)33(35)42-40-24-4-2-1-3-5-24)38-37(46)39-26-10-13-30-23(16-26)19-32(58(53,54)55)34(36(30)45)43-41-27-8-6-21-17-28(56(47,48)49)11-7-20(21)14-27;/h1-19,40-41H,(H2,38,39,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);