3,8,9-trimethoxy-5-methyl-benzo[c]phenanthridin-5-ium-2-ol dichloride

Systemtic Name: 3,8,9-trimethoxy-5-methyl-benzo[c]phenanthridin-5-ium-2-ol dichloride Openeye Name: 3,8,9-trimethoxy-5-methyl-benzo[c]phenanthridin-5-ium-2-ol dichloride CAS Name: 3,8,9-trimethoxy-5-methyl-2-benzo[c]phenanthridin-5-iumol dichloride IUPAC Name: 3,8,9-trimethoxy-5-methylbenzo[c]phenanthridin-5-ium-2-ol dichloride Traditional Name: 3,8,9-trimethoxy-5-methyl-benzo[c]phenanthridin-5-ium-2-ol dichloride Formula: C21H20Cl2NO4- MolecularWeight: 421.2938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C=C3)O)OC)OC)OC.[Cl-].[Cl-]

Isomeric SMILES

C[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C=C3)O)OC)OC)OC.[Cl-].[Cl-]

InChI

InChI=1S/C21H19NO4.2ClH/c1-22-11-13-8-19(25-3)20(26-4)9-15(13)14-6-5-12-7-17(23)18(24-2)10-16(12)21(14)22;;/h5-11H,1-4H3;2*1H/p-1