3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid

Systemtic Name: 3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid Openeye Name: 3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid CAS Name: 3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxo-6-pyrazolo[1,5-a]pyrimidinyl]propanoic acid IUPAC Name: 3-[4-ethyl-2-(2-methoxyphenyl)-5-methyl-7-oxopyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid Traditional Name: 3-[4-ethyl-7-keto-2-(2-methoxyphenyl)-5-methyl-pyrazolo[1,5-a]pyrimidin-6-yl]propionic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N2C1=CC(=N2)C3=CC=CC=C3OC)CCC(=O)O)C

Isomeric SMILES

CCN1C(=C(C(=O)N2C1=CC(=N2)C3=CC=CC=C3OC)CCC(=O)O)C

InChI

InChI=1S/C19H21N3O4/c1-4-21-12(2)13(9-10-18(23)24)19(25)22-17(21)11-15(20-22)14-7-5-6-8-16(14)26-3/h5-8,11H,4,9-10H2,1-3H3,(H,23,24)