[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 8-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: [1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 8-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl] 8-chloro-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxylic acid [1-(3-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chlorophenyl)-1-oxopropan-2-yl] 8-chloro-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxylate Traditional Name: 8-chloro-2-(4-methoxyphenyl)-3-methyl-cinchoninic acid [2-(3-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C27H21Cl2NO4 MolecularWeight: 494.36594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(=C1C(=O)OC(C)C(=O)C3=CC(=CC=C3)Cl)C=CC=C2Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(N=C2C(=C1C(=O)OC(C)C(=O)C3=CC(=CC=C3)Cl)C=CC=C2Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H21Cl2NO4/c1-15-23(27(32)34-16(2)26(31)18-6-4-7-19(28)14-18)21-8-5-9-22(29)25(21)30-24(15)17-10-12-20(33-3)13-11-17/h4-14,16H,1-3H3