hydrogen sulfate; 2,3,7,8-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium

Systemtic Name: hydrogen sulfate; 2,3,7,8-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium Openeye Name: hydrogen sulfate; 2,3,7,8-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium CAS Name: hydrogen sulfate; 2,3,7,8-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium IUPAC Name: hydrogen sulfate; 2,3,7,8-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium Traditional Name: 2,3,7,8-tetramethoxy-5-methyl-benzo[c]phenanthridin-5-ium bisulfate Formula: C22H23NO8S MolecularWeight: 461.48492

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC(=C(C=C42)OC)OC.OS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC(=C(C=C42)OC)OC.OS(=O)(=O)[O-]

InChI

InChI=1S/C22H22NO4.H2O4S/c1-23-12-17-14(8-9-18(24-2)22(17)27-5)15-7-6-13-10-19(25-3)20(26-4)11-16(13)21(15)23;1-5(2,3)4/h6-12H,1-5H3;(H2,1,2,3,4)/q+1;/p-1