N-(4-ethylphenyl)-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(4-ethylphenyl)-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-(4-ethylphenyl)-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-(4-ethylphenyl)-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-(4-ethylphenyl)-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-(4-ethylphenyl)-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C

InChI

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