4-[4-(5-chloranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-(5-chloranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(5-chloro-2-hydroxy-benzoyl)pyrazol-1-yl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-[4-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-1-pyrazolyl]-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(5-chloro-2-hydroxybenzoyl)pyrazol-1-yl]-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(5-chloro-2-hydroxy-benzoyl)pyrazol-1-yl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Formula: C23H17ClN4O7S MolecularWeight: 528.92168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3C=C(C=N3)C(=O)C4=C(C=CC(=C4)Cl)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N3C=C(C=N3)C(=O)C4=C(C=CC(=C4)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C23H17ClN4O7S/c1-35-17-5-3-16(4-6-17)26-36(33,34)18-7-8-20(21(11-18)28(31)32)27-13-14(12-25-27)23(30)19-10-15(24)2-9-22(19)29/h2-13,26,29H,1H3