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

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-nitro-benzenesulfonamide Openeye Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-nitro-benzenesulfonamide CAS Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-nitrobenzenesulfonamide IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethylbenzyl)-N-methyl-2-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c1-12-8-9-14(13(2)10-12)11-17(3)23(21,22)16-7-5-4-6-15(16)18(19)20/h4-10H,11H2,1-3H3