4-oxidanylidene-3-(pyridin-4-ylmethyl)phthalazine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-(pyridin-4-ylmethyl)phthalazine-1-carboxylic acid Openeye Name: 4-oxo-3-(4-pyridylmethyl)phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-(pyridin-4-ylmethyl)-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-(pyridin-4-ylmethyl)phthalazine-1-carboxylic acid Traditional Name: 4-keto-3-(4-pyridylmethyl)phthalazine-1-carboxylic acid Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C15H11N3O3/c19-14-12-4-2-1-3-11(12)13(15(20)21)17-18(14)9-10-5-7-16-8-6-10/h1-8H,9H2,(H,20,21)