2-cyanoethyl 1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: 2-cyanoethyl 1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: 2-cyanoethyl 1-[3-(tert-butoxycarbonylamino)propyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-4-phenyl-4-piperidinecarboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[3-(tert-butoxycarbonylamino)propyl]-4-phenyl-isonipecotic acid 2-cyanoethyl ester Formula: C23H33N3O4 MolecularWeight: 415.52582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCCC#N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCCC#N

InChI

InChI=1S/C23H33N3O4/c1-22(2,3)30-21(28)25-14-8-15-26-16-11-23(12-17-26,19-9-5-4-6-10-19)20(27)29-18-7-13-24/h4-6,9-10H,7-8,11-12,14-18H2,1-3H3,(H,25,28)