(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloranyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic 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 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid (4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C20H19ClN2O5 MolecularWeight: 402.82826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=O)N3C=CC=C(C3=N2)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=O)N3C=CC=C(C3=N2)C)OC

InChI

InChI=1S/C20H19ClN2O5/c1-4-27-18-15(21)8-13(9-16(18)26-3)20(25)28-11-14-10-17(24)23-7-5-6-12(2)19(23)22-14/h5-10H,4,11H2,1-3H3