methyl-oxidanyl-[5-phenyl-1-(2-sulfamoylphenyl)pyrazol-3-yl]-prop-2-ynoyl-azanium

Systemtic Name: methyl-oxidanyl-[5-phenyl-1-(2-sulfamoylphenyl)pyrazol-3-yl]-prop-2-ynoyl-azanium Openeye Name: hydroxy-methyl-[5-phenyl-1-(2-sulfamoylphenyl)pyrazol-3-yl]-prop-2-ynoyl-ammonium CAS Name: hydroxy-methyl-(1-oxoprop-2-ynyl)-[5-phenyl-1-(2-sulfamoylphenyl)-3-pyrazolyl]ammonium IUPAC Name: hydroxy-methyl-[5-phenyl-1-(2-sulfamoylphenyl)pyrazol-3-yl]-prop-2-ynoylazanium Traditional Name: hydroxy-methyl-[5-phenyl-1-(2-sulfamoylphenyl)pyrazol-3-yl]-propioloyl-ammonium Formula: C19H17N4O4S+ MolecularWeight: 397.42768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N4O4S/c1-3-19(24)23(2,25)18-13-16(14-9-5-4-6-10-14)22(21-18)15-11-7-8-12-17(15)28(20,26)27/h1,4-13,25H,2H3,(H2,20,26,27)/q+1