[1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate

Systemtic Name: [1-[(2-chloranyl-4-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Openeye Name: [2-(2-chloro-4-nitro-anilino)-1-methyl-2-oxo-ethyl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate CAS Name: 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid [1-(2-chloro-4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-chloro-4-nitroanilino)-1-oxopropan-2-yl] 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate Traditional Name: 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid [2-(2-chloro-4-nitro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C22H18ClN3O5 MolecularWeight: 439.84842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)OC(=O)C2=C3CCCC3=NC4=CC=CC=C42

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)OC(=O)C2=C3CCCC3=NC4=CC=CC=C42

InChI

InChI=1S/C22H18ClN3O5/c1-12(21(27)25-19-10-9-13(26(29)30)11-16(19)23)31-22(28)20-14-5-2-3-7-17(14)24-18-8-4-6-15(18)20/h2-3,5,7,9-12H,4,6,8H2,1H3,(H,25,27)