3-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C16H10ClN4O4- MolecularWeight: 357.728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=C(N=CC=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=C(N=CC=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C16H11ClN4O4/c17-14-11(6-3-7-18-14)19-12(22)8-21-15(23)10-5-2-1-4-9(10)13(20-21)16(24)25/h1-7H,8H2,(H,19,22)(H,24,25)/p-1