N-(3,5-dimethylphenyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(3,5-dimethylphenyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(3,5-dimethylphenyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(3,5-dimethylphenyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(3,5-dimethylphenyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: (3,5-dimethylphenyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C15H16N2O4S/c1-10-6-11(2)8-12(7-10)16-14-5-4-13(22(3,20)21)9-15(14)17(18)19/h4-9,16H,1-3H3