3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid

Systemtic Name: 3-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid Openeye Name: 3-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid CAS Name: 3-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid IUPAC Name: 3-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid Traditional Name: 3-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C3C(=C(C4=CC=CC=C4N3)C(=O)O)CC2)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CC2=C3C(=C(C4=CC=CC=C4N3)C(=O)O)CC2)C=C(C1=O)Br

InChI

InChI=1S/C21H16BrNO4/c1-27-17-10-11(9-15(22)20(17)24)8-12-6-7-14-18(21(25)26)13-4-2-3-5-16(13)23-19(12)14/h2-5,8-10,23H,6-7H2,1H3,(H,25,26)