1-piperidin-1-ylpropan-2-yl 3-methylbenzoate

Systemtic Name: 1-piperidin-1-ylpropan-2-yl 3-methylbenzoate Openeye Name: [1-methyl-2-(1-piperidyl)ethyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid 1-(1-piperidinyl)propan-2-yl ester IUPAC Name: 1-piperidin-1-ylpropan-2-yl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid (1-methyl-2-piperidino-ethyl) ester Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC(C)CN2CCCCC2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC(C)CN2CCCCC2

InChI

InChI=1S/C16H23NO2/c1-13-7-6-8-15(11-13)16(18)19-14(2)12-17-9-4-3-5-10-17/h6-8,11,14H,3-5,9-10,12H2,1-2H3