N-[5-(3,4-dimethylphenyl)carbonyl-2-nitro-phenyl]methanesulfonamide

Systemtic Name: N-[5-(3,4-dimethylphenyl)carbonyl-2-nitro-phenyl]methanesulfonamide Openeye Name: N-[5-(3,4-dimethylbenzoyl)-2-nitro-phenyl]methanesulfonamide CAS Name: N-[5-[(3,4-dimethylphenyl)-oxomethyl]-2-nitrophenyl]methanesulfonamide IUPAC Name: N-[5-(3,4-dimethylbenzoyl)-2-nitrophenyl]methanesulfonamide Traditional Name: N-[5-(3,4-dimethylbenzoyl)-2-nitro-phenyl]methanesulfonamide Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C)C

InChI

InChI=1S/C16H16N2O5S/c1-10-4-5-12(8-11(10)2)16(19)13-6-7-15(18(20)21)14(9-13)17-24(3,22)23/h4-9,17H,1-3H3