ethyl 1-(3-methanoyl-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-methanoyl-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3-formyl-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate CAS Name: 1-(3-formyl-9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-formyl-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(3-formyl-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)isonipecotic acid ethyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=O

InChI

InChI=1S/C18H21N3O4/c1-3-25-18(24)13-6-9-20(10-7-13)16-14(11-22)17(23)21-8-4-5-12(2)15(21)19-16/h4-5,8,11,13H,3,6-7,9-10H2,1-2H3