2-methoxy-4-(nitromethylsulfonyl)-3-phenyl-benzenesulfonamide

Systemtic Name: 2-methoxy-4-(nitromethylsulfonyl)-3-phenyl-benzenesulfonamide Openeye Name: 2-methoxy-4-(nitromethylsulfonyl)-3-phenyl-benzenesulfonamide CAS Name: 2-methoxy-4-(nitromethylsulfonyl)-3-phenylbenzenesulfonamide IUPAC Name: 2-methoxy-4-(nitromethylsulfonyl)-3-phenylbenzenesulfonamide Traditional Name: 2-methoxy-4-(nitromethylsulfonyl)-3-phenyl-benzenesulfonamide Formula: C14H14N2O7S2 MolecularWeight: 386.40016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1C2=CC=CC=C2)S(=O)(=O)C[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1C2=CC=CC=C2)S(=O)(=O)C[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C14H14N2O7S2/c1-23-14-12(25(15,21)22)8-7-11(24(19,20)9-16(17)18)13(14)10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,15,21,22)