2-[2-methyl-3-(4-methylphenyl)sulfonyl-indol-1-yl]ethylazanium

Systemtic Name: 2-[2-methyl-3-(4-methylphenyl)sulfonyl-indol-1-yl]ethylazanium Openeye Name: 2-[2-methyl-3-(p-tolylsulfonyl)indol-1-yl]ethylammonium CAS Name: 2-[2-methyl-3-(4-methylphenyl)sulfonyl-1-indolyl]ethylammonium IUPAC Name: 2-[2-methyl-3-(4-methylphenyl)sulfonylindol-1-yl]ethylazanium Traditional Name: 2-(2-methyl-3-tosyl-indol-1-yl)ethylammonium Formula: C18H21N2O2S+ MolecularWeight: 329.43654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=CC=CC=C32)CC[NH3+])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=CC=CC=C32)CC[NH3+])C

InChI

InChI=1S/C18H20N2O2S/c1-13-7-9-15(10-8-13)23(21,22)18-14(2)20(12-11-19)17-6-4-3-5-16(17)18/h3-10H,11-12,19H2,1-2H3/p+1