2-[1-oxidanylidene-4-(phenylmethyl)phthalazin-2-yl]ethanoic acid

Systemtic Name: 2-[1-oxidanylidene-4-(phenylmethyl)phthalazin-2-yl]ethanoic acid Openeye Name: 2-(4-benzyl-1-oxo-phthalazin-2-yl)acetic acid CAS Name: 2-[1-oxo-4-(phenylmethyl)-2-phthalazinyl]acetic acid IUPAC Name: 2-(4-benzyl-1-oxophthalazin-2-yl)acetic acid Traditional Name: 2-(4-benzyl-1-keto-phthalazin-2-yl)acetic acid Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)CC(=O)O

InChI

InChI=1S/C17H14N2O3/c20-16(21)11-19-17(22)14-9-5-4-8-13(14)15(18-19)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)