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

Systemtic Name: 3-[2-(3,5-dimethoxyphenyl)-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid Openeye Name: 3-[2-(3,5-dimethoxyphenyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid CAS Name: 3-[2-(3,5-dimethoxyphenyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid IUPAC Name: 3-[2-(3,5-dimethoxyphenyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propanoic acid Traditional Name: 3-[2-(3,5-dimethoxyphenyl)-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl]propionic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C=C(N2)C3=CC(=CC(=C3)OC)OC)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C=C(N2)C3=CC(=CC(=C3)OC)OC)CCC(=O)O

InChI

InChI=1S/C18H19N3O5/c1-10-14(4-5-17(22)23)18(24)21-16(19-10)9-15(20-21)11-6-12(25-2)8-13(7-11)26-3/h6-9,20H,4-5H2,1-3H3,(H,22,23)