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

Systemtic Name: ethyl 1-[3-(2,2-dicyanoethenyl)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(2,2-dicyanovinyl)-4-oxo-pyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate CAS Name: 1-[3-(2,2-dicyanoethenyl)-4-oxo-2-pyrido[1,2-a]pyrimidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2,2-dicyanoethenyl)-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate Traditional Name: 1-[3-(2,2-dicyanovinyl)-4-keto-pyrido[1,2-a]pyrimidin-2-yl]nipecotic acid ethyl ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C#N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C#N

InChI

InChI=1S/C20H19N5O3/c1-2-28-20(27)15-6-5-8-24(13-15)18-16(10-14(11-21)12-22)19(26)25-9-4-3-7-17(25)23-18/h3-4,7,9-10,15H,2,5-6,8,13H2,1H3