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

Systemtic Name: 3-butyl-2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxylic acid Openeye Name: 3-butyl-2-[(E)-2-(3-ethoxyphenyl)vinyl]-4-oxo-pyrido[1,2-a]pyrimidine-7-carboxylic acid CAS Name: 3-butyl-2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxo-7-pyrido[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 3-butyl-2-[(E)-2-(3-ethoxyphenyl)ethenyl]-4-oxopyrido[1,2-a]pyrimidine-7-carboxylic acid Traditional Name: 3-butyl-4-keto-2-[(E)-2-m-phenetylvinyl]pyrido[1,2-a]pyrimidine-7-carboxylic acid Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)C=CC3=CC(=CC=C3)OCC

Isomeric SMILES

CCCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)/C=C/C3=CC(=CC=C3)OCC

InChI

InChI=1S/C23H24N2O4/c1-3-5-9-19-20(12-10-16-7-6-8-18(14-16)29-4-2)24-21-13-11-17(23(27)28)15-25(21)22(19)26/h6-8,10-15H,3-5,9H2,1-2H3,(H,27,28)/b12-10+