4-chloranyl-3-[2-(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylhydrazinyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylhydrazinyl]benzoic acid Openeye Name: 4-chloro-3-[2-(4-oxo-3-phenyl-phthalazine-1-carbonyl)hydrazino]benzoic acid CAS Name: 4-chloro-3-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]hydrazo]benzoic acid IUPAC Name: 4-chloro-3-[2-(4-oxo-3-phenylphthalazine-1-carbonyl)hydrazinyl]benzoic acid Traditional Name: 4-chloro-3-[N'-(4-keto-3-phenyl-phthalazine-1-carbonyl)hydrazino]benzoic acid Formula: C22H15ClN4O4 MolecularWeight: 434.8319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NNC4=C(C=CC(=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NNC4=C(C=CC(=C4)C(=O)O)Cl

InChI

InChI=1S/C22H15ClN4O4/c23-17-11-10-13(22(30)31)12-18(17)24-25-20(28)19-15-8-4-5-9-16(15)21(29)27(26-19)14-6-2-1-3-7-14/h1-12,24H,(H,25,28)(H,30,31)