tert-butyl 2-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(1-benzyl-4-piperidyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1-benzylpiperidin-4-yl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(1-benzyl-4-piperidyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H33N3O3/c1-22(2,3)28-21(27)25-13-7-10-19(25)20(26)23-18-11-14-24(15-12-18)16-17-8-5-4-6-9-17/h4-6,8-9,18-19H,7,10-16H2,1-3H3,(H,23,26)