2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-oxidanylidene-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid

Systemtic Name: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-oxidanylidene-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Openeye Name: 2-[(E)-2-(2-methoxyphenyl)vinyl]-4-oxo-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid CAS Name: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-oxo-3-propyl-7-pyrido[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-oxo-3-propylpyrido[1,2-a]pyrimidine-7-carboxylic acid Traditional Name: 4-keto-2-[(E)-2-(2-methoxyphenyl)vinyl]-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)C=CC3=CC=CC=C3OC

Isomeric SMILES

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)/C=C/C3=CC=CC=C3OC

InChI

InChI=1S/C21H20N2O4/c1-3-6-16-17(11-9-14-7-4-5-8-18(14)27-2)22-19-12-10-15(21(25)26)13-23(19)20(16)24/h4-5,7-13H,3,6H2,1-2H3,(H,25,26)/b11-9+