N,N-dimethyl-4-[(E)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enoyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[(E)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enoyl]benzenesulfonamide Openeye Name: 4-[(E)-3-(4-hydroxy-3-nitro-phenyl)prop-2-enoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[(E)-3-(4-hydroxy-3-nitrophenyl)-1-oxoprop-2-enyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[(E)-3-(4-hydroxy-3-nitrophenyl)prop-2-enoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[(E)-3-(4-hydroxy-3-nitro-phenyl)acryloyl]-N,N-dimethyl-benzenesulfonamide Formula: C17H16N2O6S MolecularWeight: 376.38374

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O6S/c1-18(2)26(24,25)14-7-5-13(6-8-14)16(20)9-3-12-4-10-17(21)15(11-12)19(22)23/h3-11,21H,1-2H3/b9-3+