ethyl 1-(1H-imidazol-2-ylmethyl)-3-[(E)-3-phenylprop-2-enyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-(1H-imidazol-2-ylmethyl)-3-[(E)-3-phenylprop-2-enyl]piperidine-3-carboxylate Openeye Name: ethyl 3-[(E)-cinnamyl]-1-(1H-imidazol-2-ylmethyl)piperidine-3-carboxylate CAS Name: 1-(1H-imidazol-2-ylmethyl)-3-[(E)-3-phenylprop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-imidazol-2-ylmethyl)-3-[(E)-3-phenylprop-2-enyl]piperidine-3-carboxylate Traditional Name: 3-[(E)-cinnamyl]-1-(1H-imidazol-2-ylmethyl)nipecotic acid ethyl ester Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=NC=CN2)CC=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=NC=CN2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-2-26-20(25)21(11-6-10-18-8-4-3-5-9-18)12-7-15-24(17-21)16-19-22-13-14-23-19/h3-6,8-10,13-14H,2,7,11-12,15-17H2,1H3,(H,22,23)/b10-6+