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

Systemtic Name: ethyl 1-[[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(1,4-dioxo-3H-phthalazin-2-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[(1,4-dioxo-3H-phthalazin-2-yl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1,4-dioxo-3H-phthalazin-2-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(1,4-diketo-3H-phthalazin-2-yl)methyl]isonipecotic acid ethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4/c1-2-24-17(23)12-7-9-19(10-8-12)11-20-16(22)14-6-4-3-5-13(14)15(21)18-20/h3-6,12H,2,7-11H2,1H3,(H,18,21)