(2-chloranyl-6-fluoranyl-phenyl)methyl 3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate CAS Name: 3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Traditional Name: 3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid (2-chloro-6-fluoro-benzyl) ester Formula: C27H19ClFNO3 MolecularWeight: 459.896063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3NC2=C1C=C4C=CC(=O)C=C4)C(=O)OCC5=C(C=CC=C5Cl)F

Isomeric SMILES

C1CC2=C(C3=CC=CC=C3NC2=C1C=C4C=CC(=O)C=C4)C(=O)OCC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C27H19ClFNO3/c28-22-5-3-6-23(29)21(22)15-33-27(32)25-19-4-1-2-7-24(19)30-26-17(10-13-20(25)26)14-16-8-11-18(31)12-9-16/h1-9,11-12,14,30H,10,13,15H2