N-(4-methylphenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)ethanamide Openeye Name: N-(p-tolyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide CAS Name: N-(4-methylphenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide IUPAC Name: N-(4-methylphenyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide Traditional Name: N-(p-tolyl)-2-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)acetamide Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2=[N+](C(CC3=CC=CC=C32)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2=[N+](C(CC3=CC=CC=C32)(C)C)C

InChI

InChI=1S/C21H24N2O/c1-15-9-11-17(12-10-15)22-20(24)13-19-18-8-6-5-7-16(18)14-21(2,3)23(19)4/h5-12H,13-14H2,1-4H3/p+1