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

Systemtic Name: 3-[2-(4-methoxycarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-methoxycarbonyl-1-piperidyl)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(4-methoxycarbonyl-1-piperidinyl)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-methoxycarbonylpiperidin-1-yl)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(4-carbomethoxypiperidino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C18H18N3O6- MolecularWeight: 372.35202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6/c1-27-18(26)11-6-8-20(9-7-11)14(22)10-21-16(23)13-5-3-2-4-12(13)15(19-21)17(24)25/h2-5,11H,6-10H2,1H3,(H,24,25)/p-1