[1-[(4-methylphenyl)methyl]piperidin-4-yl] 4-methylbenzoate hydrochloride

Systemtic Name: [1-[(4-methylphenyl)methyl]piperidin-4-yl] 4-methylbenzoate hydrochloride Openeye Name: [1-(p-tolylmethyl)-4-piperidyl] 4-methylbenzoate hydrochloride CAS Name: 4-methylbenzoic acid [1-[(4-methylphenyl)methyl]-4-piperidinyl] ester hydrochloride IUPAC Name: [1-[(4-methylphenyl)methyl]piperidin-4-yl] 4-methylbenzoate hydrochloride Traditional Name: 4-methylbenzoic acid [1-(4-methylbenzyl)-4-piperidyl] ester hydrochloride Formula: C21H26ClNO2 MolecularWeight: 359.88964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)OC(=O)C3=CC=C(C=C3)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)OC(=O)C3=CC=C(C=C3)C.Cl

InChI

InChI=1S/C21H25NO2.ClH/c1-16-3-7-18(8-4-16)15-22-13-11-20(12-14-22)24-21(23)19-9-5-17(2)6-10-19;/h3-10,20H,11-15H2,1-2H3;1H