1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Openeye Name: 1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one CAS Name: 1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-propanone IUPAC Name: 1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Traditional Name: 1-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Formula: C18H19ClNO+ MolecularWeight: 300.80256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNO/c19-17-7-5-15(6-8-17)18(21)10-12-20-11-9-14-3-1-2-4-16(14)13-20/h1-8H,9-13H2/p+1