(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 4-(oxolan-2-ylmethoxy)benzoate

Systemtic Name: (4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 4-(oxolan-2-ylmethoxy)benzoate Openeye Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-(tetrahydrofuran-2-ylmethoxy)benzoate CAS Name: 4-(2-oxolanylmethoxy)benzoic acid (4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-(oxolan-2-ylmethoxy)benzoate Traditional Name: 4-(tetrahydrofurfuryloxy)benzoic acid (4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)C(=O)OCC3=CC(=O)N4C=CC=CC4=N3

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)C(=O)OCC3=CC(=O)N4C=CC=CC4=N3

InChI

InChI=1S/C21H20N2O5/c24-20-12-16(22-19-5-1-2-10-23(19)20)13-28-21(25)15-6-8-17(9-7-15)27-14-18-4-3-11-26-18/h1-2,5-10,12,18H,3-4,11,13-14H2