N-[(5-chloranyl-2-methyl-phenyl)methyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(5-chloranyl-2-methyl-phenyl)methyl]-2-nitro-benzenesulfonamide Openeye Name: N-[(5-chloro-2-methyl-phenyl)methyl]-2-nitro-benzenesulfonamide CAS Name: N-[(5-chloro-2-methylphenyl)methyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(5-chloro-2-methylphenyl)methyl]-2-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2-methyl-benzyl)-2-nitro-benzenesulfonamide Formula: C14H13ClN2O4S MolecularWeight: 340.78202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN2O4S/c1-10-6-7-12(15)8-11(10)9-16-22(20,21)14-5-3-2-4-13(14)17(18)19/h2-8,16H,9H2,1H3