[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 8-chloranyl-3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 8-chloranyl-3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 8-chloro-3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 8-chloro-3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 8-chloro-3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 8-chloro-3-methyl-2-phenyl-cinchoninic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C25H17ClN2O5 MolecularWeight: 460.86588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(=C1C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C=CC=C2Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C2C(=C1C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C=CC=C2Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H17ClN2O5/c1-15-22(25(30)33-14-21(29)17-9-5-10-18(13-17)28(31)32)19-11-6-12-20(26)24(19)27-23(15)16-7-3-2-4-8-16/h2-13H,14H2,1H3