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

Systemtic Name: ethyl 2-cyano-3-[2-(3,5-dimethylphenoxy)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Openeye Name: ethyl 2-cyano-3-[2-(3,5-dimethylphenoxy)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate CAS Name: 2-cyano-3-[2-(3,5-dimethylphenoxy)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[2-(3,5-dimethylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Traditional Name: 2-cyano-3-[2-(3,5-dimethylphenoxy)-4-keto-pyrido[1,2-a]pyrimidin-3-yl]acrylic acid ethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)OC3=CC(=CC(=C3)C)C)C#N

Isomeric SMILES

CCOC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)OC3=CC(=CC(=C3)C)C)C#N

InChI

InChI=1S/C22H19N3O4/c1-4-28-22(27)16(13-23)12-18-20(29-17-10-14(2)9-15(3)11-17)24-19-7-5-6-8-25(19)21(18)26/h5-12H,4H2,1-3H3