6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide

Systemtic Name: 6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide Openeye Name: 6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide CAS Name: 6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide IUPAC Name: 6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide Traditional Name: 6-ethyl-4-methoxy-7,8-dihydro-[1,3]dioxol[4,5-g]isoquinolin-6-ium bromide Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC2=C(C3=C(C=C2CC1)OCO3)OC.[Br-]

Isomeric SMILES

CC[N+]1=CC2=C(C3=C(C=C2CC1)OCO3)OC.[Br-]

InChI

InChI=1S/C13H16NO3.BrH/c1-3-14-5-4-9-6-11-13(17-8-16-11)12(15-2)10(9)7-14;/h6-7H,3-5,8H2,1-2H3;1H/q+1;/p-1