10-chloranyl-7-methyl-pyrido[3,2-a]phenazin-7-ium; methyl hydrogen sulfate

Systemtic Name: 10-chloranyl-7-methyl-pyrido[3,2-a]phenazin-7-ium; methyl hydrogen sulfate Openeye Name: 10-chloro-7-methyl-pyrido[3,2-a]phenazin-7-ium; methyl hydrogen sulfate CAS Name: 10-chloro-7-methylpyrido[3,2-a]phenazin-7-ium; sulfuric acid methyl ester IUPAC Name: 10-chloro-7-methylpyrido[3,2-a]phenazin-7-ium; methyl hydrogen sulfate Traditional Name: 10-chloro-7-methyl-pyrido[3,2-a]phenazin-7-ium; sulfuric acid methyl ester Formula: C17H15ClN3O4S+ MolecularWeight: 392.8367

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC3=C(C2=NC4=C1C=CC(=C4)Cl)C=CC=N3.COS(=O)(=O)O

Isomeric SMILES

C[N+]1=C2C=CC3=C(C2=NC4=C1C=CC(=C4)Cl)C=CC=N3.COS(=O)(=O)O

InChI

InChI=1S/C16H11ClN3.CH4O4S/c1-20-14-6-4-10(17)9-13(14)19-16-11-3-2-8-18-12(11)5-7-15(16)20;1-5-6(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;