2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol

Systemtic Name: 2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol Openeye Name: 2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol CAS Name: 2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol IUPAC Name: 2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol Traditional Name: 2-methoxy-12-methyl-13-phenyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium-1-ol Formula: C26H20NO4+ MolecularWeight: 410.4413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C3C=CC(=C(C3=C1C4=CC=CC=C4)O)OC)C=CC5=CC6=C(C=C52)OCO6

Isomeric SMILES

C[N+]1=C2C(=C3C=CC(=C(C3=C1C4=CC=CC=C4)O)OC)C=CC5=CC6=C(C=C52)OCO6

InChI

InChI=1S/C26H19NO4/c1-27-24(15-6-4-3-5-7-15)23-17(10-11-20(29-2)26(23)28)18-9-8-16-12-21-22(31-14-30-21)13-19(16)25(18)27/h3-13H,14H2,1-2H3/p+1