octyl (2E)-2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-5-ylidene)hexanoate

Systemtic Name: octyl (2E)-2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-5-ylidene)hexanoate Openeye Name: octyl (2E)-2-(2,4-dimethyl-6-oxo-pyrimidin-5-ylidene)hexanoate CAS Name: (2E)-2-(2,4-dimethyl-6-oxo-5-pyrimidinylidene)hexanoic acid octyl ester IUPAC Name: octyl (2E)-2-(2,4-dimethyl-6-oxopyrimidin-5-ylidene)hexanoate Traditional Name: (2E)-2-(4-keto-2,6-dimethyl-pyrimidin-5-ylidene)hexanoic acid octyl ester Formula: C20H32N2O3 MolecularWeight: 348.47968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(=C1C(=NC(=NC1=O)C)C)CCCC

Isomeric SMILES

CCCCCCCCOC(=O)/C(=C/1\C(=NC(=NC1=O)C)C)/CCCC

InChI

InChI=1S/C20H32N2O3/c1-5-7-9-10-11-12-14-25-20(24)17(13-8-6-2)18-15(3)21-16(4)22-19(18)23/h5-14H2,1-4H3/b18-17+