(2S)-4-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: (2S)-4-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: (2S)-4-[4-(4-chlorobenzoyl)-1-piperidyl]-2-isopropyl-4-oxo-butanoic acid CAS Name: (2S)-4-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: (2S)-4-[4-(4-chlorobenzoyl)piperidin-1-yl]-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: (2S)-4-[4-(4-chlorobenzoyl)piperidino]-2-isopropyl-4-keto-butyric acid Formula: C19H24ClNO4 MolecularWeight: 365.85116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)[C@H](CC(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C19H24ClNO4/c1-12(2)16(19(24)25)11-17(22)21-9-7-14(8-10-21)18(23)13-3-5-15(20)6-4-13/h3-6,12,14,16H,7-11H2,1-2H3,(H,24,25)/t16-/m0/s1