2-[3-(carboxymethyl)-4-oxidanylidene-phthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-4-oxidanylidene-phthalazin-1-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-4-oxo-phthalazin-1-yl]acetic acid CAS Name: 2-[3-(carboxymethyl)-4-oxo-1-phthalazinyl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-4-oxophthalazin-1-yl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-4-keto-phthalazin-1-yl]acetic acid Formula: C12H10N2O5 MolecularWeight: 262.2182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O5/c15-10(16)5-9-7-3-1-2-4-8(7)12(19)14(13-9)6-11(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)