(phenylmethyl) 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-(1-tert-butoxycarbonylpyrrolidin-3-yl)piperazine-1-carboxylate CAS Name: 4-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolidinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-(1-tert-butoxycarbonylpyrrolidin-3-yl)piperazine-1-carboxylic acid benzyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H31N3O4/c1-21(2,3)28-20(26)24-10-9-18(15-24)22-11-13-23(14-12-22)19(25)27-16-17-7-5-4-6-8-17/h4-8,18H,9-16H2,1-3H3