[5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)pyrazol-3-yl]methyl nitrate

Systemtic Name: [5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)pyrazol-3-yl]methyl nitrate Openeye Name: [5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)pyrazol-3-yl]methyl nitrate CAS Name: nitric acid [5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)-3-pyrazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)pyrazol-3-yl]methyl nitrate Traditional Name: nitric acid [5-(4-chlorophenyl)-3-(4-sulfamoylphenyl)pyrazol-3-yl]methyl ester Formula: C16H13ClN4O5S MolecularWeight: 408.81622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(N=N2)(CO[N+](=O)[O-])C3=CC=C(C=C3)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC(N=N2)(CO[N+](=O)[O-])C3=CC=C(C=C3)S(=O)(=O)N)Cl

InChI

InChI=1S/C16H13ClN4O5S/c17-13-5-1-11(2-6-13)15-9-16(20-19-15,10-26-21(22)23)12-3-7-14(8-4-12)27(18,24)25/h1-9H,10H2,(H2,18,24,25)