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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C(=O)N3C=CC=CC3=N2)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=C(C(=O)N3C=CC=CC3=N2)CC(=O)O

InChI

InChI=1S/C22H22N2O6/c1-3-6-15-18(9-8-14(13(2)25)21(15)28)30-12-17-16(11-20(26)27)22(29)24-10-5-4-7-19(24)23-17/h4-5,7-10,28H,3,6,11-12H2,1-2H3,(H,26,27)