5-(1-oxidanylidenephthalazin-2-yl)pentanoic acid

Systemtic Name: 5-(1-oxidanylidenephthalazin-2-yl)pentanoic acid Openeye Name: 5-(1-oxophthalazin-2-yl)pentanoic acid CAS Name: 5-(1-oxo-2-phthalazinyl)pentanoic acid IUPAC Name: 5-(1-oxophthalazin-2-yl)pentanoic acid Traditional Name: 5-(1-ketophthalazin-2-yl)valeric acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CCCCC(=O)O

InChI

InChI=1S/C13H14N2O3/c16-12(17)7-3-4-8-15-13(18)11-6-2-1-5-10(11)9-14-15/h1-2,5-6,9H,3-4,7-8H2,(H,16,17)