2-(dimethylaminomethyl)-1-propyl-cyclohexan-1-ol benzoate hydrochloride

Systemtic Name: 2-(dimethylaminomethyl)-1-propyl-cyclohexan-1-ol benzoate hydrochloride Openeye Name: 2-(dimethylaminomethyl)-1-propyl-cyclohexanol benzoate hydrochloride CAS Name: 2-(dimethylaminomethyl)-1-propyl-1-cyclohexanol benzoate hydrochloride IUPAC Name: 2-(dimethylaminomethyl)-1-propylcyclohexan-1-ol benzoate hydrochloride Traditional Name: 2-(dimethylaminomethyl)-1-propyl-cyclohexanol benzoate hydrochloride Formula: C19H31ClNO3- MolecularWeight: 356.90734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC1CN(C)C)O.C1=CC=C(C=C1)C(=O)[O-].Cl

Isomeric SMILES

CCCC1(CCCCC1CN(C)C)O.C1=CC=C(C=C1)C(=O)[O-].Cl

InChI

InChI=1S/C12H25NO.C7H6O2.ClH/c1-4-8-12(14)9-6-5-7-11(12)10-13(2)3;8-7(9)6-4-2-1-3-5-6;/h11,14H,4-10H2,1-3H3;1-5H,(H,8,9);1H/p-1