3-chloranyl-N,4-dimethyl-N-[(2-methylphenyl)methyl]-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N,4-dimethyl-N-[(2-methylphenyl)methyl]-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N,4-dimethyl-5-nitro-N-(o-tolylmethyl)benzenesulfonamide CAS Name: 3-chloro-N,4-dimethyl-N-[(2-methylphenyl)methyl]-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N,4-dimethyl-N-[(2-methylphenyl)methyl]-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N,4-dimethyl-N-(2-methylbenzyl)-5-nitro-benzenesulfonamide Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=CC=CC=C1CN(C)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C16H17ClN2O4S/c1-11-6-4-5-7-13(11)10-18(3)24(22,23)14-8-15(17)12(2)16(9-14)19(20)21/h4-9H,10H2,1-3H3