ethyl (3S)-1-[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[[(1S)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-[[(1S)-2-methyl-1-phenylpropyl]amino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-[[(1S)-2-methyl-1-phenyl-propyl]amino]ethyl]nipecotic acid ethyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CC(=O)N[C@H](C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C20H30N2O3/c1-4-25-20(24)17-11-8-12-22(13-17)14-18(23)21-19(15(2)3)16-9-6-5-7-10-16/h5-7,9-10,15,17,19H,4,8,11-14H2,1-3H3,(H,21,23)/t17-,19-/m0/s1