[1-(dimethylamino)-3-(dimethylaminomethyl)pentan-3-yl] benzoate hydrochloride

Systemtic Name: [1-(dimethylamino)-3-(dimethylaminomethyl)pentan-3-yl] benzoate hydrochloride Openeye Name: [3-(dimethylamino)-1-(dimethylaminomethyl)-1-ethyl-propyl] benzoate hydrochloride CAS Name: benzoic acid [1-(dimethylamino)-3-(dimethylaminomethyl)pentan-3-yl] ester hydrochloride IUPAC Name: [1-(dimethylamino)-3-(dimethylaminomethyl)pentan-3-yl] benzoate hydrochloride Traditional Name: benzoic acid [3-(dimethylamino)-1-(dimethylaminomethyl)-1-ethyl-propyl] ester hydrochloride Formula: C17H29ClN2O2 MolecularWeight: 328.87736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCN(C)C)(CN(C)C)OC(=O)C1=CC=CC=C1.Cl

Isomeric SMILES

CCC(CCN(C)C)(CN(C)C)OC(=O)C1=CC=CC=C1.Cl

InChI

InChI=1S/C17H28N2O2.ClH/c1-6-17(14-19(4)5,12-13-18(2)3)21-16(20)15-10-8-7-9-11-15;/h7-11H,6,12-14H2,1-5H3;1H