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

Systemtic Name: 2-[(E)-2-(2-ethoxyphenyl)ethenyl]-4-oxidanylidene-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Openeye Name: 2-[(E)-2-(2-ethoxyphenyl)vinyl]-4-oxo-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid CAS Name: 2-[(E)-2-(2-ethoxyphenyl)ethenyl]-4-oxo-3-propyl-7-pyrido[1,2-a]pyrimidinecarboxylic acid IUPAC Name: 2-[(E)-2-(2-ethoxyphenyl)ethenyl]-4-oxo-3-propylpyrido[1,2-a]pyrimidine-7-carboxylic acid Traditional Name: 4-keto-2-[(E)-2-o-phenetylvinyl]-3-propyl-pyrido[1,2-a]pyrimidine-7-carboxylic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)C=CC3=CC=CC=C3OCC

Isomeric SMILES

CCCC1=C(N=C2C=CC(=CN2C1=O)C(=O)O)/C=C/C3=CC=CC=C3OCC

InChI

InChI=1S/C22H22N2O4/c1-3-7-17-18(12-10-15-8-5-6-9-19(15)28-4-2)23-20-13-11-16(22(26)27)14-24(20)21(17)25/h5-6,8-14H,3-4,7H2,1-2H3,(H,26,27)/b12-10+