2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium iodide

Systemtic Name: 2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium iodide Openeye Name: 2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium iodide CAS Name: 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium iodide IUPAC Name: 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium iodide Traditional Name: 2,3,8,9-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium iodide Formula: C22H22INO4 MolecularWeight: 491.31885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22NO4.HI/c1-23-12-14-9-19(25-3)20(26-4)10-16(14)15-7-6-13-8-18(24-2)21(27-5)11-17(13)22(15)23;/h6-12H,1-5H3;1H/q+1;/p-1