[5-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-oxidanyl-prop-2-enoyl-azanium

Systemtic Name: [5-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-oxidanyl-prop-2-enoyl-azanium Openeye Name: [5-(3-chloro-4-fluoro-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-hydroxy-methyl-prop-2-enoyl-ammonium CAS Name: [5-(3-chloro-4-fluorophenyl)-1-(2-sulfamoylphenyl)-3-pyrazolyl]-hydroxy-methyl-(1-oxoprop-2-enyl)ammonium IUPAC Name: [5-(3-chloro-4-fluorophenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-hydroxy-methyl-prop-2-enoylazanium Traditional Name: acryloyl-[5-(3-chloro-4-fluoro-phenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-hydroxy-methyl-ammonium Formula: C19H17ClFN4O4S+ MolecularWeight: 451.879083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C1=NN(C(=C1)C2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3S(=O)(=O)N)(C(=O)C=C)O

Isomeric SMILES

C[N+](C1=NN(C(=C1)C2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3S(=O)(=O)N)(C(=O)C=C)O

InChI

InChI=1S/C19H17ClFN4O4S/c1-3-19(26)25(2,27)18-11-16(12-8-9-14(21)13(20)10-12)24(23-18)15-6-4-5-7-17(15)30(22,28)29/h3-11,27H,1H2,2H3,(H2,22,28,29)/q+1