2-methoxy-12-methyl-3-propan-2-yloxy-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium

Systemtic Name: 2-methoxy-12-methyl-3-propan-2-yloxy-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Openeye Name: 3-isopropoxy-2-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium CAS Name: 2-methoxy-12-methyl-3-propan-2-yloxy-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium IUPAC Name: 2-methoxy-12-methyl-3-propan-2-yloxy-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Traditional Name: 3-isopropoxy-2-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Formula: C23H22NO4+ MolecularWeight: 376.42508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C2C=[N+](C3=C(C2=C1)C=CC4=CC5=C(C=C43)OCO5)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C2C=[N+](C3=C(C2=C1)C=CC4=CC5=C(C=C43)OCO5)C)OC

InChI

InChI=1S/C23H22NO4/c1-13(2)28-22-9-17-15(8-19(22)25-4)11-24(3)23-16(17)6-5-14-7-20-21(10-18(14)23)27-12-26-20/h5-11,13H,12H2,1-4H3/q+1