3-methylbutyl 3-[6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoate

Systemtic Name: 3-methylbutyl 3-[6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoate Openeye Name: isopentyl 3-[6-[(E)-2-(4-methoxyphenyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoate CAS Name: 3-[6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-[6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoate Traditional Name: 3-[4-keto-6-[(E)-2-(4-methoxyphenyl)vinyl]-2-methyl-1H-pyrimidin-5-yl]propionic acid isoamyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=C(C=C2)OC)CCC(=O)OCCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=C(C=C2)OC)CCC(=O)OCCC(C)C

InChI

InChI=1S/C22H28N2O4/c1-15(2)13-14-28-21(25)12-10-19-20(23-16(3)24-22(19)26)11-7-17-5-8-18(27-4)9-6-17/h5-9,11,15H,10,12-14H2,1-4H3,(H,23,24,26)/b11-7+