3-[[3-(dimethylsulfamoyl)phenyl]methyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[[3-(dimethylsulfamoyl)phenyl]methyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[[3-(dimethylsulfamoyl)phenyl]methyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[[3-(dimethylsulfamoyl)phenyl]methyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[[3-(dimethylsulfamoyl)phenyl]methyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[3-(dimethylsulfamoyl)benzyl]-4-keto-phthalazine-1-carboxylate Formula: C18H16N3O5S- MolecularWeight: 386.40174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C18H17N3O5S/c1-20(2)27(25,26)13-7-5-6-12(10-13)11-21-17(22)15-9-4-3-8-14(15)16(19-21)18(23)24/h3-10H,11H2,1-2H3,(H,23,24)/p-1