2-methylpropyl 3-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)propanoate

Systemtic Name: 2-methylpropyl 3-(6-methyl-4-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)propanoate Openeye Name: isobutyl 3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanoate CAS Name: 3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(4-keto-6-methyl-2-phenyl-1H-pyrimidin-5-yl)propionic acid isobutyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC=CC=C2)CCC(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC=CC=C2)CCC(=O)OCC(C)C

InChI

InChI=1S/C18H22N2O3/c1-12(2)11-23-16(21)10-9-15-13(3)19-17(20-18(15)22)14-7-5-4-6-8-14/h4-8,12H,9-11H2,1-3H3,(H,19,20,22)