phenacyl 6-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: phenacyl 6-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: phenacyl 2-(4-benzyloxyphenyl)-6-chloro-3-methyl-quinoline-4-carboxylate CAS Name: 6-chloro-3-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 6-chloro-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-chloro-3-methyl-cinchoninic acid phenacyl ester Formula: C32H24ClNO4 MolecularWeight: 521.99026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=CC=C3)Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OCC(=O)C3=CC=CC=C3)Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C32H24ClNO4/c1-21-30(32(36)38-20-29(35)23-10-6-3-7-11-23)27-18-25(33)14-17-28(27)34-31(21)24-12-15-26(16-13-24)37-19-22-8-4-2-5-9-22/h2-18H,19-20H2,1H3