ethyl 1-[4-oxidanylidene-4-[[(2R)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-oxidanylidene-4-[[(2R)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[[(1R)-1-methyl-3-phenyl-propyl]amino]-4-oxo-butanoyl]piperidine-4-carboxylate CAS Name: 1-[1,4-dioxo-4-[[(2R)-4-phenylbutan-2-yl]amino]butyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-oxo-4-[[(2R)-4-phenylbutan-2-yl]amino]butanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-keto-4-[[(1R)-1-methyl-3-phenyl-propyl]amino]butanoyl]isonipecotic acid ethyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)N[C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C22H32N2O4/c1-3-28-22(27)19-13-15-24(16-14-19)21(26)12-11-20(25)23-17(2)9-10-18-7-5-4-6-8-18/h4-8,17,19H,3,9-16H2,1-2H3,(H,23,25)/t17-/m1/s1