3-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)benzoic acid

Systemtic Name: 3-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)benzoic acid Openeye Name: 3-(1-oxo-4-phenyl-phthalazin-2-yl)benzoic acid CAS Name: 3-(1-oxo-4-phenyl-2-phthalazinyl)benzoic acid IUPAC Name: 3-(1-oxo-4-phenylphthalazin-2-yl)benzoic acid Traditional Name: 3-(1-keto-4-phenyl-phthalazin-2-yl)benzoic acid Formula: C21H14N2O3 MolecularWeight: 342.34746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H14N2O3/c24-20-18-12-5-4-11-17(18)19(14-7-2-1-3-8-14)22-23(20)16-10-6-9-15(13-16)21(25)26/h1-13H,(H,25,26)