(phenylmethyl) 4-[[(1-methylpyrrol-2-yl)carbonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[(1-methylpyrrol-2-yl)carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(1-methylpyrrole-2-carbonyl)amino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1C(=O)NCC2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3/c1-22-11-5-8-18(22)19(24)21-14-16-9-12-23(13-10-16)20(25)26-15-17-6-3-2-4-7-17/h2-8,11,16H,9-10,12-15H2,1H3,(H,21,24)