N-(3-ethylphenyl)-2,4-dinitro-benzenesulfonamide

Systemtic Name: N-(3-ethylphenyl)-2,4-dinitro-benzenesulfonamide Openeye Name: N-(3-ethylphenyl)-2,4-dinitro-benzenesulfonamide CAS Name: N-(3-ethylphenyl)-2,4-dinitrobenzenesulfonamide IUPAC Name: N-(3-ethylphenyl)-2,4-dinitrobenzenesulfonamide Traditional Name: N-(3-ethylphenyl)-2,4-dinitro-benzenesulfonamide Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O6S/c1-2-10-4-3-5-11(8-10)15-24(22,23)14-7-6-12(16(18)19)9-13(14)17(20)21/h3-9,15H,2H2,1H3