N-(4-butoxyphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(4-butoxyphenyl)-2-nitro-benzenesulfonamide Openeye Name: N-(4-butoxyphenyl)-2-nitro-benzenesulfonamide CAS Name: N-(4-butoxyphenyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(4-butoxyphenyl)-2-nitrobenzenesulfonamide Traditional Name: N-(4-butoxyphenyl)-2-nitro-benzenesulfonamide Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5S/c1-2-3-12-23-14-10-8-13(9-11-14)17-24(21,22)16-7-5-4-6-15(16)18(19)20/h4-11,17H,2-3,12H2,1H3