propan-2-yl 3-[[1-(4-chlorophenyl)carbonylpiperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[[1-(4-chlorophenyl)carbonylpiperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[1-(4-chlorobenzoyl)piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[1-(4-chlorobenzoyl)piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-[[1-(4-chlorobenzoyl)isonipecotoyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C25H29ClN2O4 MolecularWeight: 456.96176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H29ClN2O4/c1-17(2)32-23(29)16-22(18-6-4-3-5-7-18)27-24(30)19-12-14-28(15-13-19)25(31)20-8-10-21(26)11-9-20/h3-11,17,19,22H,12-16H2,1-2H3,(H,27,30)