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

Systemtic Name: methyl (2S)-2-(4,4-dimethyl-6-oxidanylidene-5H-pyrimidin-1-yl)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(4,4-dimethyl-6-oxo-5H-pyrimidin-1-yl)-3-phenyl-propanoate CAS Name: (2S)-2-(4,4-dimethyl-6-oxo-5H-pyrimidin-1-yl)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(4,4-dimethyl-6-oxo-5H-pyrimidin-1-yl)-3-phenylpropanoate Traditional Name: (2S)-2-(6-keto-4,4-dimethyl-5H-pyrimidin-1-yl)-3-phenyl-propionic acid methyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C=N1)C(CC2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CC1(CC(=O)N(C=N1)[C@@H](CC2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C16H20N2O3/c1-16(2)10-14(19)18(11-17-16)13(15(20)21-3)9-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/t13-/m0/s1