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

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 8-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-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-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-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-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C28H24ClNO5 MolecularWeight: 489.94686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24ClNO5/c1-16-24(28(32)35-17(2)27(31)19-10-14-21(34-4)15-11-19)22-6-5-7-23(29)26(22)30-25(16)18-8-12-20(33-3)13-9-18/h5-15,17H,1-4H3