2-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[[4-[(4-fluorophenyl)sulfonylamino]phenyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]ethyl-diisopropyl-ammonium Formula: C21H29FN3O3S+ MolecularWeight: 422.536663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)F)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)F)C(C)C

InChI

InChI=1S/C21H28FN3O3S/c1-15(2)25(16(3)4)14-13-23-21(26)17-5-9-19(10-6-17)24-29(27,28)20-11-7-18(22)8-12-20/h5-12,15-16,24H,13-14H2,1-4H3,(H,23,26)/p+1