[1-(phenylmethyl)piperidin-4-yl] 2,4,5-trimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Openeye Name: (1-benzyl-4-piperidyl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid [1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: (1-benzylpiperidin-4-yl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid (1-benzyl-4-piperidyl) ester Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC2CCN(CC2)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC2CCN(CC2)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C20H26N2O2/c1-14-15(2)21-16(3)19(14)20(23)24-18-9-11-22(12-10-18)13-17-7-5-4-6-8-17/h4-8,18,21H,9-13H2,1-3H3