N-[(1R,2R)-2-azanylcyclohexyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-azanylcyclohexyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-aminocyclohexyl]-4-nitro-benzenesulfonamide CAS Name: N-[(1R,2R)-2-aminocyclohexyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-aminocyclohexyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(1R,2R)-2-aminocyclohexyl]-4-nitro-benzenesulfonamide Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@@H](C1)N)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4S/c13-11-3-1-2-4-12(11)14-20(18,19)10-7-5-9(6-8-10)15(16)17/h5-8,11-12,14H,1-4,13H2/t11-,12-/m1/s1