2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium

Systemtic Name: 2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Openeye Name: 2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium CAS Name: 2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium IUPAC Name: 2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Traditional Name: 2,2-dimethoxy-12-methyl-1H-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Formula: C21H20NO4+ MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C3C=CC(CC3=C1)(OC)OC)C=CC4=CC5=C(C=C42)OCO5

Isomeric SMILES

C[N+]1=C2C(=C3C=CC(CC3=C1)(OC)OC)C=CC4=CC5=C(C=C42)OCO5

InChI

InChI=1S/C21H20NO4/c1-22-11-14-10-21(23-2,24-3)7-6-15(14)16-5-4-13-8-18-19(26-12-25-18)9-17(13)20(16)22/h4-9,11H,10,12H2,1-3H3/q+1