(1-phenyl-2-piperidin-1-yl-ethyl) 2-methylbenzoate

Systemtic Name: (1-phenyl-2-piperidin-1-yl-ethyl) 2-methylbenzoate Openeye Name: [1-phenyl-2-(1-piperidyl)ethyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (1-phenyl-2-piperidin-1-ylethyl) 2-methylbenzoate Traditional Name: 2-methylbenzoic acid (1-phenyl-2-piperidino-ethyl) ester Formula: C21H25NO2 MolecularWeight: 323.4287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC(CN2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC(CN2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO2/c1-17-10-6-7-13-19(17)21(23)24-20(18-11-4-2-5-12-18)16-22-14-8-3-9-15-22/h2,4-7,10-13,20H,3,8-9,14-16H2,1H3