(3,3-dimethyl-1-pyrrolidin-1-yl-butan-2-yl) benzoate hydrochloride

Systemtic Name: (3,3-dimethyl-1-pyrrolidin-1-yl-butan-2-yl) benzoate hydrochloride Openeye Name: [2,2-dimethyl-1-(pyrrolidin-1-ylmethyl)propyl] benzoate hydrochloride CAS Name: benzoic acid [3,3-dimethyl-1-(1-pyrrolidinyl)butan-2-yl] ester hydrochloride IUPAC Name: (3,3-dimethyl-1-pyrrolidin-1-ylbutan-2-yl) benzoate hydrochloride Traditional Name: benzoic acid [2,2-dimethyl-1-(pyrrolidinomethyl)propyl] ester hydrochloride Formula: C17H26ClNO2 MolecularWeight: 311.84684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1CCCC1)OC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

CC(C)(C)C(CN1CCCC1)OC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C17H25NO2.ClH/c1-17(2,3)15(13-18-11-7-8-12-18)20-16(19)14-9-5-4-6-10-14;/h4-6,9-10,15H,7-8,11-13H2,1-3H3;1H