methyl 4-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-1-propan-2-yl-piperidine-3-carboxylate

Systemtic Name: methyl 4-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-1-propan-2-yl-piperidine-3-carboxylate Openeye Name: methyl 4-[3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]-1-isopropyl-piperidine-3-carboxylate CAS Name: 4-[2-oxo-3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]-1-propan-2-yl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-oxo-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-1-propan-2-ylpiperidine-3-carboxylate Traditional Name: 4-[3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]-1-isopropyl-nipecotic acid methyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)N1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O5/c1-15(2)24-11-10-19(17(13-24)21(27)29-3)25-12-9-18(20(25)26)23-22(28)30-14-16-7-5-4-6-8-16/h4-8,15,17-19H,9-14H2,1-3H3,(H,23,28)