3-(1,2,4-oxadiazol-3-ylmethyl)-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-(1,2,4-oxadiazol-3-ylmethyl)-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-(1,2,4-oxadiazol-3-ylmethyl)-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-(1,2,4-oxadiazol-3-ylmethyl)-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-(1,2,4-oxadiazol-3-ylmethyl)-4-oxophthalazine-1-carboxylic acid Traditional Name: 4-keto-3-(1,2,4-oxadiazol-3-ylmethyl)phthalazine-1-carboxylic acid Formula: C12H8N4O4 MolecularWeight: 272.21632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=NOC=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=NOC=N3)C(=O)O

InChI

InChI=1S/C12H8N4O4/c17-11-8-4-2-1-3-7(8)10(12(18)19)14-16(11)5-9-13-6-20-15-9/h1-4,6H,5H2,(H,18,19)