1-ethyl-2,3,3-trimethyl-5-(phenylsulfonyl)indol-1-ium

Systemtic Name: 1-ethyl-2,3,3-trimethyl-5-(phenylsulfonyl)indol-1-ium Openeye Name: 5-(benzenesulfonyl)-1-ethyl-2,3,3-trimethyl-indol-1-ium CAS Name: 5-(benzenesulfonyl)-1-ethyl-2,3,3-trimethylindol-1-ium IUPAC Name: 5-(benzenesulfonyl)-1-ethyl-2,3,3-trimethylindol-1-ium Traditional Name: 5-besyl-1-ethyl-2,3,3-trimethyl-indol-1-ium Formula: C19H22NO2S+ MolecularWeight: 328.44848

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(C2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)(C)C)C

Isomeric SMILES

CC[N+]1=C(C(C2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)(C)C)C

InChI

InChI=1S/C19H22NO2S/c1-5-20-14(2)19(3,4)17-13-16(11-12-18(17)20)23(21,22)15-9-7-6-8-10-15/h6-13H,5H2,1-4H3/q+1