sodium 8-azanyl-5-[2-[4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]hydrazinyl]naphthalene-2-sulfonate

Systemtic Name: sodium 8-azanyl-5-[2-[4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]hydrazinyl]naphthalene-2-sulfonate Openeye Name: sodium 8-amino-5-[2-[4-(4-oxocyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]hydrazino]naphthalene-2-sulfonate CAS Name: sodium 8-amino-5-[2-[4-(4-oxo-1-cyclohexa-2,5-dienylidene)-1-cyclohexa-2,5-dienylidene]hydrazinyl]-2-naphthalenesulfonate IUPAC Name: sodium 8-amino-5-[2-[4-(4-oxocyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]hydrazinyl]naphthalene-2-sulfonate Traditional Name: sodium 8-amino-5-[N'-[4-(4-ketocyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-ylidene]hydrazino]naphthalene-2-sulfonate Formula: C22H16N3NaO4S MolecularWeight: 441.43491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NNC2=C3C=CC(=CC3=C(C=C2)N)S(=O)(=O)[O-])C=CC1=C4C=CC(=O)C=C4.[Na+]

Isomeric SMILES

C1=CC(=NNC2=C3C=CC(=CC3=C(C=C2)N)S(=O)(=O)[O-])C=CC1=C4C=CC(=O)C=C4.[Na+]

InChI

InChI=1S/C22H17N3O4S.Na/c23-21-11-12-22(19-10-9-18(13-20(19)21)30(27,28)29)25-24-16-5-1-14(2-6-16)15-3-7-17(26)8-4-15;/h1-13,25H,23H2,(H,27,28,29);/q;+1/p-1