N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline Traditional Name: (2,4-dimethylbenzyl)-(4-mesyl-2-nitro-phenyl)-methyl-amine Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-12-5-6-14(13(2)9-12)11-18(3)16-8-7-15(24(4,22)23)10-17(16)19(20)21/h5-10H,11H2,1-4H3