N-[(4S)-hept-1-en-4-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(4S)-hept-1-en-4-yl]-2-nitro-benzenesulfonamide Openeye Name: 2-nitro-N-[(1S)-1-propylbut-3-enyl]benzenesulfonamide CAS Name: N-[(4S)-hept-1-en-4-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(4S)-hept-1-en-4-yl]-2-nitrobenzenesulfonamide Traditional Name: 2-nitro-N-[(1S)-1-propylbut-3-enyl]benzenesulfonamide Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@H](CC=C)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O4S/c1-3-7-11(8-4-2)14-20(18,19)13-10-6-5-9-12(13)15(16)17/h3,5-6,9-11,14H,1,4,7-8H2,2H3/t11-/m1/s1