4-[(3,5-dimethoxyphenyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(3,5-dimethoxyphenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: 4-(3,5-dimethoxyanilino)-3-nitro-benzenesulfonamide CAS Name: 4-(3,5-dimethoxyanilino)-3-nitrobenzenesulfonamide IUPAC Name: 4-(3,5-dimethoxyanilino)-3-nitrobenzenesulfonamide Traditional Name: 4-(3,5-dimethoxyanilino)-3-nitro-benzenesulfonamide Formula: C14H15N3O6S MolecularWeight: 353.3504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC

InChI

InChI=1S/C14H15N3O6S/c1-22-10-5-9(6-11(7-10)23-2)16-13-4-3-12(24(15,20)21)8-14(13)17(18)19/h3-8,16H,1-2H3,(H2,15,20,21)