(3-chlorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3-chlorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (3-chlorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]ammonium CAS Name: (3-chlorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]ammonium IUPAC Name: (3-chlorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]azanium Traditional Name: (3-chlorobenzyl)-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]ammonium Formula: C18H20ClN2O+ MolecularWeight: 315.8172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C[NH2+]CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C[NH2+]CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H19ClN2O/c19-17-7-3-4-14(10-17)11-20-12-18(22)21-9-8-15-5-1-2-6-16(15)13-21/h1-7,10,20H,8-9,11-13H2/p+1