2-[(E)-2-(2-ethoxy-5-methoxy-phenyl)ethenyl]-3-ethyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxylic acid

Systemtic Name: 2-[(E)-2-(2-ethoxy-5-methoxy-phenyl)ethenyl]-3-ethyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxylic acid Openeye Name: 2-[(E)-2-(2-ethoxy-5-methoxy-phenyl)vinyl]-3-ethyl-4-oxo-pyrido[1,2-a]pyrimidine-7-carboxylic acid CAS Name: 2-[(E)-2-(2-ethoxy-5-methoxyphenyl)ethenyl]-3-ethyl-4-oxo-7-pyrido[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 2-[(E)-2-(2-ethoxy-5-methoxyphenyl)ethenyl]-3-ethyl-4-oxopyrido[1,2-a]pyrimidine-7-carboxylic acid Traditional Name: 2-[(E)-2-(2-ethoxy-5-methoxy-phenyl)vinyl]-3-ethyl-4-keto-pyrido[1,2-a]pyrimidine-7-carboxylic acid Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)C=CC3=C(C=CC(=C3)OC)OCC

Isomeric SMILES

CCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)/C=C/C3=C(C=CC(=C3)OC)OCC

InChI

InChI=1S/C22H22N2O5/c1-4-17-18(9-6-14-12-16(28-3)8-10-19(14)29-5-2)23-20-11-7-15(22(26)27)13-24(20)21(17)25/h6-13H,4-5H2,1-3H3,(H,26,27)/b9-6+