2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid

Systemtic Name: 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 2-[6-[(E)-2-(4-bromophenyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid CAS Name: 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 2-[6-[(E)-2-(4-bromophenyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]propionic acid Formula: C16H15BrN2O3 MolecularWeight: 363.2059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=C(C=C2)Br)C(C)C(=O)O

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=C(C=C2)Br)C(C)C(=O)O

InChI

InChI=1S/C16H15BrN2O3/c1-9(16(21)22)14-13(18-10(2)19-15(14)20)8-5-11-3-6-12(17)7-4-11/h3-9H,1-2H3,(H,21,22)(H,18,19,20)/b8-5+