3-(2-methoxyphenyl)-N-(2-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)propanamide

Systemtic Name: 3-(2-methoxyphenyl)-N-(2-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)propanamide Openeye Name: N-(2-isopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propanamide CAS Name: 3-(2-methoxyphenyl)-N-(2-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)propanamide IUPAC Name: 3-(2-methoxyphenyl)-N-(2-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)propanamide Traditional Name: N-(2-isopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)-3-(2-methoxyphenyl)propionamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC2=C(C1)C=C(C=C2)NC(=O)CCC3=CC=CC=C3OC

Isomeric SMILES

CC(C)[NH+]1CCC2=C(C1)C=C(C=C2)NC(=O)CCC3=CC=CC=C3OC

InChI

InChI=1S/C22H28N2O2/c1-16(2)24-13-12-17-8-10-20(14-19(17)15-24)23-22(25)11-9-18-6-4-5-7-21(18)26-3/h4-8,10,14,16H,9,11-13,15H2,1-3H3,(H,23,25)/p+1