ethyl 1-[3-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]-9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(E)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate CAS Name: 1-[3-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-3-carboxylate Traditional Name: 1-[3-[(E)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl]nipecotic acid ethyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C23H26N4O5/c1-4-31-22(29)16-9-7-10-26(14-16)20-18(12-17(13-24)23(30)32-5-2)21(28)27-11-6-8-15(3)19(27)25-20/h6,8,11-12,16H,4-5,7,9-10,14H2,1-3H3/b17-12+