N-(4-hydroxyphenyl)-2-methyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide

Systemtic Name: N-(4-hydroxyphenyl)-2-methyl-5-(4-oxidanylidene-3H-phthalazin-1-yl)benzenesulfonamide Openeye Name: N-(4-hydroxyphenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide CAS Name: N-(4-hydroxyphenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide IUPAC Name: N-(4-hydroxyphenyl)-2-methyl-5-(4-oxo-3H-phthalazin-1-yl)benzenesulfonamide Traditional Name: N-(4-hydroxyphenyl)-5-(4-keto-3H-phthalazin-1-yl)-2-methyl-benzenesulfonamide Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NC4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)NC4=CC=C(C=C4)O

InChI

InChI=1S/C21H17N3O4S/c1-13-6-7-14(20-17-4-2-3-5-18(17)21(26)23-22-20)12-19(13)29(27,28)24-15-8-10-16(25)11-9-15/h2-12,24-25H,1H3,(H,23,26)