3-nitro-4-(3-oxidanylpropylamino)-N-phenyl-benzenesulfonamide

Systemtic Name: 3-nitro-4-(3-oxidanylpropylamino)-N-phenyl-benzenesulfonamide Openeye Name: 4-(3-hydroxypropylamino)-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-(3-hydroxypropylamino)-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-(3-hydroxypropylamino)-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-(3-hydroxypropylamino)-3-nitro-N-phenyl-benzenesulfonamide Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O5S/c19-10-4-9-16-14-8-7-13(11-15(14)18(20)21)24(22,23)17-12-5-2-1-3-6-12/h1-3,5-8,11,16-17,19H,4,9-10H2