methyl 4-[(3S)-3-(4-chlorophenyl)carbonylpiperidin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[(3S)-3-(4-chlorophenyl)carbonylpiperidin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[(3S)-3-(4-chlorobenzoyl)piperidine-1-carbonyl]benzoate CAS Name: 4-[[(3S)-3-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-(4-chlorobenzoyl)piperidine-1-carbonyl]benzoate Traditional Name: 4-[(3S)-3-(4-chlorobenzoyl)piperidine-1-carbonyl]benzoic acid methyl ester Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO4/c1-27-21(26)16-6-4-15(5-7-16)20(25)23-12-2-3-17(13-23)19(24)14-8-10-18(22)11-9-14/h4-11,17H,2-3,12-13H2,1H3/t17-/m0/s1