2-[6-methyl-4-oxidanylidene-2-[(4-propoxyphenyl)methyl]-1H-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-4-oxidanylidene-2-[(4-propoxyphenyl)methyl]-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[6-methyl-4-oxo-2-[(4-propoxyphenyl)methyl]-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[6-methyl-4-oxo-2-[(4-propoxyphenyl)methyl]-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[6-methyl-4-oxo-2-[(4-propoxyphenyl)methyl]-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[4-keto-6-methyl-2-(4-propoxybenzyl)-1H-pyrimidin-5-yl]acetic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC2=NC(=O)C(=C(N2)C)CC(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC2=NC(=O)C(=C(N2)C)CC(=O)O

InChI

InChI=1S/C17H20N2O4/c1-3-8-23-13-6-4-12(5-7-13)9-15-18-11(2)14(10-16(20)21)17(22)19-15/h4-7H,3,8-10H2,1-2H3,(H,20,21)(H,18,19,22)