N'-(3-nitro-4-oxidanyl-phenyl)sulfonyl-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-nitro-4-oxidanyl-phenyl)sulfonyl-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carbohydrazide Openeye Name: N'-(4-hydroxy-3-nitro-phenyl)sulfonyl-3-isopropyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-(4-hydroxy-3-nitrophenyl)sulfonyl-4-oxo-3-propan-2-yl-1-phthalazinecarbohydrazide IUPAC Name: N'-(4-hydroxy-3-nitrophenyl)sulfonyl-4-oxo-3-propan-2-ylphthalazine-1-carbohydrazide Traditional Name: N'-(4-hydroxy-3-nitro-phenyl)sulfonyl-3-isopropyl-4-keto-phthalazine-1-carbohydrazide Formula: C18H17N5O7S MolecularWeight: 447.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O7S/c1-10(2)22-18(26)13-6-4-3-5-12(13)16(20-22)17(25)19-21-31(29,30)11-7-8-15(24)14(9-11)23(27)28/h3-10,21,24H,1-2H3,(H,19,25)