pentyl 2-[6-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate

Systemtic Name: pentyl 2-[6-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate Openeye Name: pentyl 2-[6-[(E)-2-(2,3-dimethoxyphenyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate CAS Name: 2-[6-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoic acid pentyl ester IUPAC Name: pentyl 2-[6-[(E)-2-(2,3-dimethoxyphenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate Traditional Name: 2-[6-[(E)-2-(2,3-dimethoxyphenyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]hexanoic acid amyl ester Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)C=CC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)/C=C/C2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C26H36N2O5/c1-6-8-10-17-33-26(30)20(13-9-7-2)23-21(27-18(3)28-25(23)29)16-15-19-12-11-14-22(31-4)24(19)32-5/h11-12,14-16,20H,6-10,13,17H2,1-5H3,(H,27,28,29)/b16-15+