2-methyl-9-(4-methylphenyl)sulfonyl-3,4-dihydropyrido[3,4-b]indol-2-ium iodide

Systemtic Name: 2-methyl-9-(4-methylphenyl)sulfonyl-3,4-dihydropyrido[3,4-b]indol-2-ium iodide Openeye Name: 2-methyl-9-(p-tolylsulfonyl)-3,4-dihydropyrido[3,4-b]indol-2-ium iodide CAS Name: 2-methyl-9-(4-methylphenyl)sulfonyl-3,4-dihydropyrido[3,4-b]indol-2-ium iodide IUPAC Name: 2-methyl-9-(4-methylphenyl)sulfonyl-3,4-dihydropyrido[3,4-b]indol-2-ium iodide Traditional Name: 2-methyl-9-tosyl-3,4-dihydro-$b-carbolin-2-ium iodide Formula: C19H19IN2O2S MolecularWeight: 466.33583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C4=C2C=[N+](CC4)C.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C4=C2C=[N+](CC4)C.[I-]

InChI

InChI=1S/C19H19N2O2S.HI/c1-14-7-9-15(10-8-14)24(22,23)21-18-6-4-3-5-16(18)17-11-12-20(2)13-19(17)21;/h3-10,13H,11-12H2,1-2H3;1H/q+1;/p-1