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

Systemtic Name: [1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 8-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-8-chloro-3-methyl-quinoline-4-carboxylate CAS Name: 8-chloro-3-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-1-oxopropan-2-yl] 8-chloro-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-8-chloro-3-methyl-cinchoninic acid [2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C34H28ClNO5 MolecularWeight: 566.04282

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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)OCC5=CC=CC=C5

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)OCC5=CC=CC=C5

InChI

InChI=1S/C34H28ClNO5/c1-21-30(34(38)41-22(2)33(37)25-14-16-26(39-3)17-15-25)28-10-7-11-29(35)32(28)36-31(21)24-12-18-27(19-13-24)40-20-23-8-5-4-6-9-23/h4-19,22H,20H2,1-3H3