N-butyl-2-nitro-N-phenethyl-benzenesulfonamide

Systemtic Name: N-butyl-2-nitro-N-phenethyl-benzenesulfonamide Openeye Name: N-butyl-2-nitro-N-phenethyl-benzenesulfonamide CAS Name: N-butyl-2-nitro-N-phenethylbenzenesulfonamide IUPAC Name: N-butyl-2-nitro-N-phenethylbenzenesulfonamide Traditional Name: N-butyl-2-nitro-N-phenethyl-benzenesulfonamide Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O4S/c1-2-3-14-19(15-13-16-9-5-4-6-10-16)25(23,24)18-12-8-7-11-17(18)20(21)22/h4-12H,2-3,13-15H2,1H3