ethyl (E)-2-cyano-3-(2-morpholin-4-yl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-(2-morpholin-4-yl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(2-morpholino-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(4-morpholinyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(2-morpholin-4-yl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-keto-2-morpholino-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)acrylic acid ethyl ester Formula: C18H19N4O4+ MolecularWeight: 355.36786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(NC2=CC=CC=[N+]2C1=O)N3CCOCC3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(NC2=CC=CC=[N+]2C1=O)N3CCOCC3)/C#N

InChI

InChI=1S/C18H18N4O4/c1-2-26-18(24)13(12-19)11-14-16(21-7-9-25-10-8-21)20-15-5-3-4-6-22(15)17(14)23/h3-6,11H,2,7-10H2,1H3/p+1/b13-11+