(1-phenethylpiperidin-4-yl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: (1-phenethylpiperidin-4-yl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Openeye Name: (1-phenethyl-4-piperidyl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid (1-phenethyl-4-piperidinyl) ester IUPAC Name: (1-phenethylpiperidin-4-yl) 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid (1-phenethyl-4-piperidyl) ester Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC2CCN(CC2)CCC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC2CCN(CC2)CCC3=CC=CC=C3)C)C

InChI

InChI=1S/C21H28N2O2/c1-15-16(2)22-17(3)20(15)21(24)25-19-10-13-23(14-11-19)12-9-18-7-5-4-6-8-18/h4-8,19,22H,9-14H2,1-3H3