methyl 1-[3-(2,2-dimethylpropanoylamino)phenyl]carbonyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(2,2-dimethylpropanoylamino)phenyl]carbonyl-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[3-(2,2-dimethylpropanoylamino)benzoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(2,2-dimethylpropanoylamino)benzoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 4-phenyl-1-[3-(pivaloylamino)benzoyl]isonipecotic acid methyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H30N2O4/c1-24(2,3)22(29)26-20-12-8-9-18(17-20)21(28)27-15-13-25(14-16-27,23(30)31-4)19-10-6-5-7-11-19/h5-12,17H,13-16H2,1-4H3,(H,26,29)