methyl 1-methyl-4-[(phenylmethyl)amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-methyl-4-[(phenylmethyl)amino]cyclohexane-1-carboxylate Openeye Name: methyl 4-(benzylamino)-1-methyl-cyclohexanecarboxylate CAS Name: 1-methyl-4-[(phenylmethyl)amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-1-methylcyclohexane-1-carboxylate Traditional Name: 4-(benzylamino)-1-methyl-cyclohexanecarboxylic acid methyl ester Formula: C16H23NO2 MolecularWeight: 261.35932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)NCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1(CCC(CC1)NCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H23NO2/c1-16(15(18)19-2)10-8-14(9-11-16)17-12-13-6-4-3-5-7-13/h3-7,14,17H,8-12H2,1-2H3