[1-(C,N-dimethylcarbonimidoyl)piperidin-4-yl] 3,5-dimethylbenzoate hydrochloride

Systemtic Name: [1-(C,N-dimethylcarbonimidoyl)piperidin-4-yl] 3,5-dimethylbenzoate hydrochloride Openeye Name: [1-(C,N-dimethylcarbonimidoyl)-4-piperidyl] 3,5-dimethylbenzoate hydrochloride CAS Name: 3,5-dimethylbenzoic acid [1-(1-methyliminoethyl)-4-piperidinyl] ester hydrochloride IUPAC Name: [1-(C,N-dimethylcarbonimidoyl)piperidin-4-yl] 3,5-dimethylbenzoate hydrochloride Traditional Name: 3,5-dimethylbenzoic acid [1-(C,N-dimethylcarbonimidoyl)-4-piperidyl] ester hydrochloride Formula: C17H25ClN2O2 MolecularWeight: 324.8456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OC2CCN(CC2)C(=NC)C)C.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OC2CCN(CC2)C(=NC)C)C.Cl

InChI

InChI=1S/C17H24N2O2.ClH/c1-12-9-13(2)11-15(10-12)17(20)21-16-5-7-19(8-6-16)14(3)18-4;/h9-11,16H,5-8H2,1-4H3;1H