2-[2-[3-[(2-fluorophenyl)methylsulfonyl]indol-1-yl]ethanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[3-[(2-fluorophenyl)methylsulfonyl]indol-1-yl]ethanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-[3-[(2-fluorophenyl)methylsulfonyl]indol-1-yl]acetyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-[3-[(2-fluorophenyl)methylsulfonyl]-1-indolyl]-1-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-[3-[(2-fluorophenyl)methylsulfonyl]indol-1-yl]acetyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-[3-(2-fluorobenzyl)sulfonylindol-1-yl]acetyl]amino]ethyl-dimethyl-ammonium Formula: C21H25FN3O3S+ MolecularWeight: 418.504903

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=CC=CC=C3F

Isomeric SMILES

C[NH+](C)CCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O3S/c1-24(2)12-11-23-21(26)14-25-13-20(17-8-4-6-10-19(17)25)29(27,28)15-16-7-3-5-9-18(16)22/h3-10,13H,11-12,14-15H2,1-2H3,(H,23,26)/p+1