N-(2-diethylaminoethyl)-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-(2-diethylaminoethyl)-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-(2-diethylaminoethyl)-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-(2-diethylaminoethyl)-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-(2-diethylaminoethyl)-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-(2-diethylaminoethyl)-4-hydroxy-3-nitro-benzenesulfonamide Formula: C12H19N3O5S MolecularWeight: 317.36136

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNS(=O)(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNS(=O)(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O5S/c1-3-14(4-2)8-7-13-21(19,20)10-5-6-12(16)11(9-10)15(17)18/h5-6,9,13,16H,3-4,7-8H2,1-2H3