2-[7-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]ethanoic acid

Systemtic Name: 2-[7-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[7-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]acetic acid CAS Name: 2-[7-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxo-3-pyrido[1,2-a]pyrimidinyl]acetic acid IUPAC Name: 2-[7-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]acetic acid Traditional Name: 2-[7-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-keto-pyrido[1,2-a]pyrimidin-3-yl]acetic acid Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CN3C(=NC=C(C3=O)CC(=O)O)C=C2

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CN3C(=NC=C(C3=O)CC(=O)O)C=C2

InChI

InChI=1S/C22H22N2O6/c1-3-4-17-18(7-6-16(13(2)25)21(17)28)30-12-14-5-8-19-23-10-15(9-20(26)27)22(29)24(19)11-14/h5-8,10-11,28H,3-4,9,12H2,1-2H3,(H,26,27)