octyl 2-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: octyl 2-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)ethanoate Openeye Name: octyl 2-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)acetate CAS Name: 2-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)acetic acid octyl ester IUPAC Name: octyl 2-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)acetate Traditional Name: 2-(4-keto-6-methyl-2-phenyl-1H-pyrimidin-5-yl)acetic acid octyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CC1=C(NC(=NC1=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCCCCCCOC(=O)CC1=C(NC(=NC1=O)C2=CC=CC=C2)C

InChI

InChI=1S/C21H28N2O3/c1-3-4-5-6-7-11-14-26-19(24)15-18-16(2)22-20(23-21(18)25)17-12-9-8-10-13-17/h8-10,12-13H,3-7,11,14-15H2,1-2H3,(H,22,23,25)