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

Systemtic Name: pentyl 2-[6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate Openeye Name: pentyl 2-[6-[(E)-2-(2-furyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate CAS Name: 2-[6-[(E)-2-(2-furanyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoic acid pentyl ester IUPAC Name: pentyl 2-[6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate Traditional Name: 2-[6-[(E)-2-(2-furyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]hexanoic acid amyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)C=CC2=CC=CO2

Isomeric SMILES

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)/C=C/C2=CC=CO2

InChI

InChI=1S/C22H30N2O4/c1-4-6-8-14-28-22(26)18(11-7-5-2)20-19(23-16(3)24-21(20)25)13-12-17-10-9-15-27-17/h9-10,12-13,15,18H,4-8,11,14H2,1-3H3,(H,23,24,25)/b13-12+