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

Systemtic Name: [1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl] 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Openeye Name: [1-[(E)-cinnamyl]-4-piperidyl] 2,4,5-trimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid [1-[(E)-3-phenylprop-2-enyl]-4-piperidinyl] ester IUPAC Name: [1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl] 2,4,5-trimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4,5-trimethyl-1H-pyrrole-3-carboxylic acid [1-[(E)-cinnamyl]-4-piperidyl] ester Formula: C22H28N2O2 MolecularWeight: 352.46992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O2/c1-16-17(2)23-18(3)21(16)22(25)26-20-11-14-24(15-12-20)13-7-10-19-8-5-4-6-9-19/h4-10,20,23H,11-15H2,1-3H3/b10-7+