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

Systemtic Name: 2-ethoxy-1-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Openeye Name: 2-ethoxy-1-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium CAS Name: 2-ethoxy-1-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium IUPAC Name: 2-ethoxy-1-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Traditional Name: 2-ethoxy-1-methoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium Formula: C22H20NO4+ MolecularWeight: 362.3985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=C[N+](=C3C(=C2C=C1)C=CC4=CC5=C(C=C43)OCO5)C)OC

Isomeric SMILES

CCOC1=C(C2=C[N+](=C3C(=C2C=C1)C=CC4=CC5=C(C=C43)OCO5)C)OC

InChI

InChI=1S/C22H20NO4/c1-4-25-18-8-7-14-15-6-5-13-9-19-20(27-12-26-19)10-16(13)21(15)23(2)11-17(14)22(18)24-3/h5-11H,4,12H2,1-3H3/q+1