ethyl 1-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(1,4-diketo-3H-phthalazin-2-yl)acetyl]isonipecotic acid ethyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C18H21N3O5/c1-2-26-18(25)12-7-9-20(10-8-12)15(22)11-21-17(24)14-6-4-3-5-13(14)16(23)19-21/h3-6,12H,2,7-11H2,1H3,(H,19,23)