propyl 2-[phenyl(pyridin-3-ylmethyl)carbamoyl]cyclohexene-1-carboxylate

Systemtic Name: propyl 2-[phenyl(pyridin-3-ylmethyl)carbamoyl]cyclohexene-1-carboxylate Openeye Name: propyl 2-[phenyl(3-pyridylmethyl)carbamoyl]cyclohexene-1-carboxylate CAS Name: 2-[oxo-[N-(3-pyridinylmethyl)anilino]methyl]-1-cyclohexenecarboxylic acid propyl ester IUPAC Name: propyl 2-[phenyl(pyridin-3-ylmethyl)carbamoyl]cyclohexene-1-carboxylate Traditional Name: 2-[phenyl(3-pyridylmethyl)carbamoyl]cyclohexene-1-carboxylic acid propyl ester Formula: C23H26N2O3 MolecularWeight: 378.46414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3/c1-2-15-28-23(27)21-13-7-6-12-20(21)22(26)25(19-10-4-3-5-11-19)17-18-9-8-14-24-16-18/h3-5,8-11,14,16H,2,6-7,12-13,15,17H2,1H3