2-[1-[(4-aminophenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]ethanamide

Systemtic Name: 2-[1-[(4-aminophenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]ethanamide Openeye Name: 2-[1-[(4-aminophenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]acetamide CAS Name: 2-[1-[(4-aminophenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]acetamide IUPAC Name: 2-[1-[(4-aminophenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]acetamide Traditional Name: 2-[1-(4-aminobenzyl)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)N)OC)OC)CC(=O)N

Isomeric SMILES

C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)N)OC)OC)CC(=O)N

InChI

InChI=1S/C21H27N3O3/c1-24(13-21(23)25)9-8-15-11-19(26-2)20(27-3)12-17(15)18(24)10-14-4-6-16(22)7-5-14/h4-7,11-12,18H,8-10,13,22H2,1-3H3,(H-,23,25)/p+1