3-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide

Systemtic Name: 3-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Openeye Name: 3-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide CAS Name: 3-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide IUPAC Name: 3-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Traditional Name: 3-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Formula: C15H18N4O7S2 MolecularWeight: 430.45602

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O7S2/c1-2-7-17-12-5-3-10(27(16,23)24)8-13(12)18-28(25,26)11-4-6-15(20)14(9-11)19(21)22/h3-6,8-9,17-18,20H,2,7H2,1H3,(H2,16,23,24)