3-nitro-N-(4-phenylbutyl)benzenesulfonamide

Systemtic Name: 3-nitro-N-(4-phenylbutyl)benzenesulfonamide Openeye Name: 3-nitro-N-(4-phenylbutyl)benzenesulfonamide CAS Name: 3-nitro-N-(4-phenylbutyl)benzenesulfonamide IUPAC Name: 3-nitro-N-(4-phenylbutyl)benzenesulfonamide Traditional Name: 3-nitro-N-(4-phenylbutyl)benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c19-18(20)15-10-6-11-16(13-15)23(21,22)17-12-5-4-9-14-7-2-1-3-8-14/h1-3,6-8,10-11,13,17H,4-5,9,12H2