N-cyclopropyl-3-nitro-4-oxidanyl-N-propyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-3-nitro-4-oxidanyl-N-propyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-hydroxy-3-nitro-N-propyl-benzenesulfonamide CAS Name: N-cyclopropyl-4-hydroxy-3-nitro-N-propylbenzenesulfonamide IUPAC Name: N-cyclopropyl-4-hydroxy-3-nitro-N-propylbenzenesulfonamide Traditional Name: N-cyclopropyl-4-hydroxy-3-nitro-N-propyl-benzenesulfonamide Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCCN(C1CC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O5S/c1-2-7-13(9-3-4-9)20(18,19)10-5-6-12(15)11(8-10)14(16)17/h5-6,8-9,15H,2-4,7H2,1H3