N-(2-ethyl-6-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(2-ethyl-6-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NS(=O)(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C

InChI

InChI=1S/C16H18N2O4S/c1-4-13-7-5-6-12(3)16(13)17-23(21,22)14-9-8-11(2)15(10-14)18(19)20/h5-10,17H,4H2,1-3H3