(2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl) benzoate hydrochloride

Systemtic Name: (2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl) benzoate hydrochloride Openeye Name: (1-allyl-2,5-dimethyl-4-piperidyl) benzoate hydrochloride CAS Name: benzoic acid (2,5-dimethyl-1-prop-2-enyl-4-piperidinyl) ester hydrochloride IUPAC Name: (2,5-dimethyl-1-prop-2-enylpiperidin-4-yl) benzoate hydrochloride Traditional Name: benzoic acid (1-allyl-2,5-dimethyl-4-piperidyl) ester hydrochloride Formula: C17H24ClNO2 MolecularWeight: 309.83096

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(CN1CC=C)C)OC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

CC1CC(C(CN1CC=C)C)OC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C17H23NO2.ClH/c1-4-10-18-12-13(2)16(11-14(18)3)20-17(19)15-8-6-5-7-9-15;/h4-9,13-14,16H,1,10-12H2,2-3H3;1H