4-oxidanylidene-3-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]phthalazine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]phthalazine-1-carboxylic acid Openeye Name: 4-oxo-3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]phthalazine-1-carboxylic acid Traditional Name: 4-keto-3-[3-(2-keto-3H-benzimidazol-1-yl)propyl]phthalazine-1-carboxylic acid Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCCN3C4=CC=CC=C4NC3=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCCN3C4=CC=CC=C4NC3=O)C(=O)O

InChI

InChI=1S/C19H16N4O4/c24-17-13-7-2-1-6-12(13)16(18(25)26)21-23(17)11-5-10-22-15-9-4-3-8-14(15)20-19(22)27/h1-4,6-9H,5,10-11H2,(H,20,27)(H,25,26)