N-butyl-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: N-butyl-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: N-butyl-3-nitro-N-phenyl-benzenesulfonamide CAS Name: N-butyl-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-butyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: N-butyl-3-nitro-N-phenyl-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-2-3-12-17(14-8-5-4-6-9-14)23(21,22)16-11-7-10-15(13-16)18(19)20/h4-11,13H,2-3,12H2,1H3