(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(6-methyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(6-methyl-1-benzofuran-3-yl)ethanoate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(6-methylbenzofuran-3-yl)acetate CAS Name: 2-(6-methyl-3-benzofuranyl)acetic acid (9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 2-(6-methyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methylbenzofuran-3-yl)acetic acid (4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=CC(=O)N4C=CC=C(C4=N3)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=CC(=O)N4C=CC=C(C4=N3)C

InChI

InChI=1S/C21H18N2O4/c1-13-5-6-17-15(11-26-18(17)8-13)9-20(25)27-12-16-10-19(24)23-7-3-4-14(2)21(23)22-16/h3-8,10-11H,9,12H2,1-2H3