(3E)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid

Systemtic Name: (3E)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid Openeye Name: (3E)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid CAS Name: (3E)-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid IUPAC Name: (3E)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid Traditional Name: (3E)-3-(6-ketocyclohexa-2,4-dien-1-ylidene)-8-sulfo-4H-benzo[f]quinoline-1-carboxylic acid Formula: C20H13NO6S MolecularWeight: 395.38532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(C3=C(N2)C=CC4=C3C=CC(=C4)S(=O)(=O)O)C(=O)O)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\2/C=C(C3=C(N2)C=CC4=C3C=CC(=C4)S(=O)(=O)O)C(=O)O)/C(=O)C=C1

InChI

InChI=1S/C20H13NO6S/c22-18-4-2-1-3-14(18)17-10-15(20(23)24)19-13-7-6-12(28(25,26)27)9-11(13)5-8-16(19)21-17/h1-10,21H,(H,23,24)(H,25,26,27)/b17-14+