3-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-(3-azanyl-3-oxidanylidene-propyl)-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-(3-amino-3-oxo-propyl)-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-(3-amino-3-oxopropyl)-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-(3-amino-3-oxopropyl)-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-(3-amino-3-keto-propyl)-4-keto-phthalazine-1-carboxylic acid Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O4/c13-9(16)5-6-15-11(17)8-4-2-1-3-7(8)10(14-15)12(18)19/h1-4H,5-6H2,(H2,13,16)(H,18,19)