N-[(1S,3S,4R)-3-bicyclo[2.2.1]heptanyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(1S,3S,4R)-3-bicyclo[2.2.1]heptanyl]-4-nitro-benzenesulfonamide Openeye Name: 4-nitro-N-[(1R,2S,4S)-norbornan-2-yl]benzenesulfonamide CAS Name: N-[(1S,3S,4R)-3-bicyclo[2.2.1]heptanyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(1S,3S,4R)-3-bicyclo[2.2.1]heptanyl]-4-nitrobenzenesulfonamide Traditional Name: 4-nitro-N-[(1R,2S,4S)-norbornan-2-yl]benzenesulfonamide Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H]2C[C@H]1C[C@@H]2NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O4S/c16-15(17)11-3-5-12(6-4-11)20(18,19)14-13-8-9-1-2-10(13)7-9/h3-6,9-10,13-14H,1-2,7-8H2/t9-,10+,13-/m0/s1