N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]dibenzofuran-2-sulfonamide

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]dibenzofuran-2-sulfonamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]dibenzofuran-2-sulfonamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2-dibenzofuransulfonamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]dibenzofuran-2-sulfonamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]dibenzofuran-2-sulfonamide Formula: C21H18N2O7S2 MolecularWeight: 474.50682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

InChI

InChI=1S/C21H18N2O7S2/c1-13-9-15(10-14(2)21(13)31(26,27)12-23(24)25)22-32(28,29)16-7-8-20-18(11-16)17-5-3-4-6-19(17)30-20/h3-11,22H,12H2,1-2H3