(phenylmethyl) 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: benzyl 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: 6-[(1E,3E)-1-ethoxyhexa-1,3-dienyl]-3,4-dihydro-2H-pyridine-1-carboxylic acid benzyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC=C(C1=CCCCN1C(=O)OCC2=CC=CC=C2)OCC

Isomeric SMILES

CC/C=C/C=C(\C1=CCCCN1C(=O)OCC2=CC=CC=C2)/OCC

InChI

InChI=1S/C21H27NO3/c1-3-5-7-15-20(24-4-2)19-14-10-11-16-22(19)21(23)25-17-18-12-8-6-9-13-18/h5-9,12-15H,3-4,10-11,16-17H2,1-2H3/b7-5+,20-15+