4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)phthalazine-1-carboxylate

Systemtic Name: 4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)phthalazine-1-carboxylate Openeye Name: 4-oxo-3-[2-oxo-2-(1-piperidyl)ethyl]phthalazine-1-carboxylate CAS Name: 4-oxo-3-[2-oxo-2-(1-piperidinyl)ethyl]-1-phthalazinecarboxylate IUPAC Name: 4-oxo-3-(2-oxo-2-piperidin-1-ylethyl)phthalazine-1-carboxylate Traditional Name: 4-keto-3-(2-keto-2-piperidino-ethyl)phthalazine-1-carboxylate Formula: C16H16N3O4- MolecularWeight: 314.31594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C16H17N3O4/c20-13(18-8-4-1-5-9-18)10-19-15(21)12-7-3-2-6-11(12)14(17-19)16(22)23/h2-3,6-7H,1,4-5,8-10H2,(H,22,23)/p-1