2-(dimethylaminomethyl)-1-(2-methylphenyl)prop-2-en-1-one hydrochloride

Systemtic Name: 2-(dimethylaminomethyl)-1-(2-methylphenyl)prop-2-en-1-one hydrochloride Openeye Name: 2-(dimethylaminomethyl)-1-(o-tolyl)prop-2-en-1-one hydrochloride CAS Name: 2-(dimethylaminomethyl)-1-(2-methylphenyl)-2-propen-1-one hydrochloride IUPAC Name: 2-(dimethylaminomethyl)-1-(2-methylphenyl)prop-2-en-1-one hydrochloride Traditional Name: 2-(dimethylaminomethyl)-1-(o-tolyl)prop-2-en-1-one hydrochloride Formula: C13H18ClNO MolecularWeight: 239.74112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(=C)CN(C)C.Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)C(=C)CN(C)C.Cl

InChI

InChI=1S/C13H17NO.ClH/c1-10-7-5-6-8-12(10)13(15)11(2)9-14(3)4;/h5-8H,2,9H2,1,3-4H3;1H