N-[3-methyl-4-oxidanyl-5-(phenylsulfonyl)phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-methyl-4-oxidanyl-5-(phenylsulfonyl)phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-4-hydroxy-5-methyl-phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-4-hydroxy-5-methylphenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-4-hydroxy-5-methylphenyl]-3-nitrobenzenesulfonamide Traditional Name: N-(3-besyl-4-hydroxy-5-methyl-phenyl)-3-nitro-benzenesulfonamide Formula: C19H16N2O7S2 MolecularWeight: 448.46954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)S(=O)(=O)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O)S(=O)(=O)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O7S2/c1-13-10-14(20-30(27,28)17-9-5-6-15(12-17)21(23)24)11-18(19(13)22)29(25,26)16-7-3-2-4-8-16/h2-12,20,22H,1H3