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

Systemtic Name: 2-[3-[(1-methylbenzimidazol-2-yl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoic acid Openeye Name: 2-[3-[(1-methylbenzimidazol-2-yl)methyl]-4-oxo-phthalazin-1-yl]acetic acid CAS Name: 2-[3-[(1-methyl-2-benzimidazolyl)methyl]-4-oxo-1-phthalazinyl]acetic acid IUPAC Name: 2-[3-[(1-methylbenzimidazol-2-yl)methyl]-4-oxophthalazin-1-yl]acetic acid Traditional Name: 2-[4-keto-3-[(1-methylbenzimidazol-2-yl)methyl]phthalazin-1-yl]acetic acid Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN3C(=O)C4=CC=CC=C4C(=N3)CC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN3C(=O)C4=CC=CC=C4C(=N3)CC(=O)O

InChI

InChI=1S/C19H16N4O3/c1-22-16-9-5-4-8-14(16)20-17(22)11-23-19(26)13-7-3-2-6-12(13)15(21-23)10-18(24)25/h2-9H,10-11H2,1H3,(H,24,25)