(2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)ethanamide chloride

Systemtic Name: (2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)ethanamide chloride Openeye Name: (2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)acetamide chloride CAS Name: (2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)acetamide chloride IUPAC Name: (2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)acetamide chloride Traditional Name: (2Z)-N-phenyl-2-(2,3,3-trimethyl-2,4-dihydroisoquinolin-2-ium-1-ylidene)acetamide chloride Formula: C20H23ClN2O MolecularWeight: 342.86242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=CC(=O)NC3=CC=CC=C3)[NH+]1C)C.[Cl-]

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C/C(=O)NC3=CC=CC=C3)/[NH+]1C)C.[Cl-]

InChI

InChI=1S/C20H22N2O.ClH/c1-20(2)14-15-9-7-8-12-17(15)18(22(20)3)13-19(23)21-16-10-5-4-6-11-16;/h4-13H,14H2,1-3H3,(H,21,23);1H/b18-13-;