5-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-2-chloranyl-benzoic acid

Systemtic Name: 5-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-2-chloranyl-benzoic acid Openeye Name: 2-chloro-5-(1,4-dioxo-3H-phthalazin-2-yl)benzoic acid CAS Name: 2-chloro-5-(1,4-dioxo-3H-phthalazin-2-yl)benzoic acid IUPAC Name: 2-chloro-5-(1,4-dioxo-3H-phthalazin-2-yl)benzoic acid Traditional Name: 2-chloro-5-(1,4-diketo-3H-phthalazin-2-yl)benzoic acid Formula: C15H9ClN2O4 MolecularWeight: 316.69596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C15H9ClN2O4/c16-12-6-5-8(7-11(12)15(21)22)18-14(20)10-4-2-1-3-9(10)13(19)17-18/h1-7H,(H,17,19)(H,21,22)