3-[9-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]propanoic acid

Systemtic Name: 3-[9-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]propanoic acid Openeye Name: 3-[9-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]propanoic acid CAS Name: 3-[9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxo-3-pyrido[1,2-a]pyrimidinyl]propanoic acid IUPAC Name: 3-[9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]propanoic acid Traditional Name: 3-[9-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-keto-pyrido[1,2-a]pyrimidin-3-yl]propionic acid Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=O)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=O)CCC(=O)O

InChI

InChI=1S/C23H24N2O6/c1-3-5-18-19(9-8-17(14(2)26)21(18)29)31-13-16-6-4-11-25-22(16)24-12-15(23(25)30)7-10-20(27)28/h4,6,8-9,11-12,29H,3,5,7,10,13H2,1-2H3,(H,27,28)