(4-methoxyphenyl)-(5,6,7-trimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methanone

Systemtic Name: (4-methoxyphenyl)-(5,6,7-trimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methanone Openeye Name: (4-methoxyphenyl)-(5,6,7-trimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methanone CAS Name: (4-methoxyphenyl)-(5,6,7-trimethoxy-2-methyl-1-isoquinolin-2-iumyl)methanone IUPAC Name: (4-methoxyphenyl)-(5,6,7-trimethoxy-2-methylisoquinolin-2-ium-1-yl)methanone Traditional Name: (4-methoxyphenyl)-(5,6,7-trimethoxy-2-methyl-isoquinolin-2-ium-1-yl)methanone Formula: C21H22NO5+ MolecularWeight: 368.40308

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C2=CC(=C(C(=C2C=C1)OC)OC)OC)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[N+]1=C(C2=CC(=C(C(=C2C=C1)OC)OC)OC)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22NO5/c1-22-11-10-15-16(12-17(25-3)21(27-5)20(15)26-4)18(22)19(23)13-6-8-14(24-2)9-7-13/h6-12H,1-5H3/q+1