sodium (3E)-6-oxidanylidene-3-[[4-[(2E)-2-(8-oxidanyl-1-oxidanylidene-4-sulfo-naphthalen-2-ylidene)hydrazinyl]naphthalen-1-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: sodium (3E)-6-oxidanylidene-3-[[4-[(2E)-2-(8-oxidanyl-1-oxidanylidene-4-sulfo-naphthalen-2-ylidene)hydrazinyl]naphthalen-1-yl]hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate Openeye Name: sodium (3E)-3-[[4-[(2E)-2-(8-hydroxy-1-oxo-4-sulfo-2-naphthylidene)hydrazino]-1-naphthyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylate CAS Name: sodium (3E)-3-[[4-[(2E)-2-(8-hydroxy-1-oxo-4-sulfo-2-naphthalenylidene)hydrazinyl]-1-naphthalenyl]hydrazinylidene]-6-oxo-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: sodium (3E)-3-[[4-[(2E)-2-(8-hydroxy-1-oxo-4-sulfonaphthalen-2-ylidene)hydrazinyl]naphthalen-1-yl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylate Traditional Name: sodium (3E)-3-[[4-[(N'E)-N'-(8-hydroxy-1-keto-4-sulfo-2-naphthylidene)hydrazino]-1-naphthyl]hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylate Formula: C27H17N4NaO8S MolecularWeight: 580.50065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2NN=C3C=C(C4=C(C3=O)C(=CC=C4)O)S(=O)(=O)O)NN=C5C=CC(=O)C(=C5)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2N/N=C/3\C=C(C4=C(C3=O)C(=CC=C4)O)S(=O)(=O)O)N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-].[Na+]

InChI

InChI=1S/C27H18N4O8S.Na/c32-22-11-8-14(12-18(22)27(35)36)28-29-19-9-10-20(16-5-2-1-4-15(16)19)30-31-21-13-24(40(37,38)39)17-6-3-7-23(33)25(17)26(21)34;/h1-13,29-30,33H,(H,35,36)(H,37,38,39);/q;+1/p-1/b28-14+,31-21+;