N-[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]-3-nitro-benzenesulfonamide CAS Name: N-[2-(3,4-dichlorophenyl)-5-methyl-3-pyrazolyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-5-methylpyrazol-3-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]-3-nitro-benzenesulfonamide Formula: C16H12Cl2N4O4S MolecularWeight: 427.26188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=NN(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H12Cl2N4O4S/c1-10-7-16(21(19-10)11-5-6-14(17)15(18)9-11)20-27(25,26)13-4-2-3-12(8-13)22(23)24/h2-9,20H,1H3