pyridin-2-ylmethyl 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoate

Systemtic Name: pyridin-2-ylmethyl 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoate Openeye Name: 2-pyridylmethyl 2-(1,4-dioxo-3H-phthalazin-2-yl)acetate CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)acetic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 2-(1,4-dioxo-3H-phthalazin-2-yl)acetate Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)acetic acid 2-pyridylmethyl ester Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC(=O)OCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CC(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C16H13N3O4/c20-14(23-10-11-5-3-4-8-17-11)9-19-16(22)13-7-2-1-6-12(13)15(21)18-19/h1-8H,9-10H2,(H,18,21)