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

Systemtic Name: [5-(4-methoxyphenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-oxidanyl-prop-2-enoyl-azanium Openeye Name: hydroxy-[5-(4-methoxyphenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-prop-2-enoyl-ammonium CAS Name: hydroxy-[5-(4-methoxyphenyl)-1-(2-sulfamoylphenyl)-3-pyrazolyl]-methyl-(1-oxoprop-2-enyl)ammonium IUPAC Name: hydroxy-[5-(4-methoxyphenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-prop-2-enoylazanium Traditional Name: acryloyl-hydroxy-[5-(4-methoxyphenyl)-1-(2-sulfamoylphenyl)pyrazol-3-yl]-methyl-ammonium Formula: C20H21N4O5S+ MolecularWeight: 429.46954

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C20H21N4O5S/c1-4-20(25)24(2,26)19-13-17(14-9-11-15(29-3)12-10-14)23(22-19)16-7-5-6-8-18(16)30(21,27)28/h4-13,26H,1H2,2-3H3,(H2,21,27,28)/q+1