methyl 4-[ethanoyl-(phenylmethyl)amino]cyclohexene-1-carboxylate

Systemtic Name: methyl 4-[ethanoyl-(phenylmethyl)amino]cyclohexene-1-carboxylate Openeye Name: methyl 4-[acetyl(benzyl)amino]cyclohexene-1-carboxylate CAS Name: 4-[acetyl-(phenylmethyl)amino]-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl 4-[acetyl(benzyl)amino]cyclohexene-1-carboxylate Traditional Name: 4-[acetyl(benzyl)amino]cyclohexene-1-carboxylic acid methyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CC=CC=C1)C2CCC(=CC2)C(=O)OC

Isomeric SMILES

CC(=O)N(CC1=CC=CC=C1)C2CCC(=CC2)C(=O)OC

InChI

InChI=1S/C17H21NO3/c1-13(19)18(12-14-6-4-3-5-7-14)16-10-8-15(9-11-16)17(20)21-2/h3-8,16H,9-12H2,1-2H3