2-(3,4-dichlorophenyl)-1-[1-(2,5-dihydropyrrol-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride

Systemtic Name: 2-(3,4-dichlorophenyl)-1-[1-(2,5-dihydropyrrol-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride Openeye Name: 2-(3,4-dichlorophenyl)-1-[1-(2,5-dihydropyrrol-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride CAS Name: 2-(3,4-dichlorophenyl)-1-[1-(2,5-dihydropyrrol-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride IUPAC Name: 2-(3,4-dichlorophenyl)-1-[1-(2,5-dihydropyrrol-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride Traditional Name: 2-(3,4-dichlorophenyl)-1-[1-(3-pyrrolin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone hydrochloride Formula: C22H23Cl3N2O MolecularWeight: 437.78982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CN3CC=CC3)C(=O)CC4=CC(=C(C=C4)Cl)Cl.Cl

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CN3CC=CC3)C(=O)CC4=CC(=C(C=C4)Cl)Cl.Cl

InChI

InChI=1S/C22H22Cl2N2O.ClH/c23-19-8-7-16(13-20(19)24)14-22(27)26-12-9-17-5-1-2-6-18(17)21(26)15-25-10-3-4-11-25;/h1-8,13,21H,9-12,14-15H2;1H