[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-methylbenzoate

Systemtic Name: [2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-methylbenzoate Openeye Name: [2-[(2-methyl-1-piperidyl)methyl]phenyl]methyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-[(2-methyl-1-piperidinyl)methyl]phenyl]methyl ester IUPAC Name: [2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[(2-methylpiperidino)methyl]benzyl] ester Formula: C22H27NO2 MolecularWeight: 337.45528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=CC=CC=C2COC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CC1CCCCN1CC2=CC=CC=C2COC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C22H27NO2/c1-17-8-7-12-19(14-17)22(24)25-16-21-11-4-3-10-20(21)15-23-13-6-5-9-18(23)2/h3-4,7-8,10-12,14,18H,5-6,9,13,15-16H2,1-2H3