(phenylmethyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(piperidin-4-ylmethyl)piperidine-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(piperidin-4-ylmethyl)piperidine-2-carboxylate Openeye Name: benzyl 4-(tert-butoxycarbonylamino)-1-(4-piperidylmethyl)piperidine-2-carboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-(4-piperidinylmethyl)-2-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(piperidin-4-ylmethyl)piperidine-2-carboxylate Traditional Name: 4-(tert-butoxycarbonylamino)-1-(4-piperidylmethyl)pipecolinic acid benzyl ester Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C(C1)C(=O)OCC2=CC=CC=C2)CC3CCNCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C(C1)C(=O)OCC2=CC=CC=C2)CC3CCNCC3

InChI

InChI=1S/C24H37N3O4/c1-24(2,3)31-23(29)26-20-11-14-27(16-18-9-12-25-13-10-18)21(15-20)22(28)30-17-19-7-5-4-6-8-19/h4-8,18,20-21,25H,9-17H2,1-3H3,(H,26,29)