methyl (E)-2-cyano-3-(4-oxidanylidene-2-pyrrolidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(4-oxidanylidene-2-pyrrolidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(4-oxo-2-pyrrolidin-1-yl-pyrido[1,2-a]pyrimidin-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[4-oxo-2-(1-pyrrolidinyl)-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-keto-2-pyrrolidino-pyrido[1,2-a]pyrimidin-3-yl)acrylic acid methyl ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)N3CCCC3)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=C(N=C2C=CC=CN2C1=O)N3CCCC3)/C#N

InChI

InChI=1S/C17H16N4O3/c1-24-17(23)12(11-18)10-13-15(20-7-4-5-8-20)19-14-6-2-3-9-21(14)16(13)22/h2-3,6,9-10H,4-5,7-8H2,1H3/b12-10+