2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-1-thiophen-2-yl-ethanone

Systemtic Name: 2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-1-thiophen-2-yl-ethanone Openeye Name: 2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-1-(2-thienyl)ethanone CAS Name: 2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-1-thiophen-2-ylethanone IUPAC Name: 2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl)-1-thiophen-2-ylethanone Traditional Name: 2-(4-methoxy-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl)-1-(2-thienyl)ethanone Formula: C19H22NO4S+ MolecularWeight: 360.44728

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC3=C(C(=C2C1CC(=O)C4=CC=CS4)OC)OCO3)C

Isomeric SMILES

C[N+]1(CCC2=CC3=C(C(=C2C1CC(=O)C4=CC=CS4)OC)OCO3)C

InChI

InChI=1S/C19H22NO4S/c1-20(2)7-6-12-9-15-18(24-11-23-15)19(22-3)17(12)13(20)10-14(21)16-5-4-8-25-16/h4-5,8-9,13H,6-7,10-11H2,1-3H3/q+1