N-(3-methylphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide chloride

Systemtic Name: N-(3-methylphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide chloride Openeye Name: N-(m-tolyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide chloride CAS Name: N-(3-methylphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide chloride IUPAC Name: N-(3-methylphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide chloride Traditional Name: N-(m-tolyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propionamide chloride Formula: C19H23ClN2O MolecularWeight: 330.85172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC[NH+]2CCC3=CC=CC=C3C2.[Cl-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC[NH+]2CCC3=CC=CC=C3C2.[Cl-]

InChI

InChI=1S/C19H22N2O.ClH/c1-15-5-4-8-18(13-15)20-19(22)10-12-21-11-9-16-6-2-3-7-17(16)14-21;/h2-8,13H,9-12,14H2,1H3,(H,20,22);1H