propan-2-yl 3-[[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[1-[(3,5-dimethylphenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-[[1-(3,5-dimethylbenzoyl)nipecotoyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3)C

InChI

InChI=1S/C27H34N2O4/c1-18(2)33-25(30)16-24(21-9-6-5-7-10-21)28-26(31)22-11-8-12-29(17-22)27(32)23-14-19(3)13-20(4)15-23/h5-7,9-10,13-15,18,22,24H,8,11-12,16-17H2,1-4H3,(H,28,31)