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

Systemtic Name: 3-(2-ethyl-5-methyl-7-oxidanylidene-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Openeye Name: 3-(2-ethyl-5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid CAS Name: 3-(2-ethyl-5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid IUPAC Name: 3-(2-ethyl-5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Traditional Name: 3-(2-ethyl-7-keto-5-methyl-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propionic acid Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC(=C(C(=O)N2N1)CCC(=O)O)C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C2=NC(=C(C(=O)N2N1)CCC(=O)O)C)C3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3/c1-3-14-16(12-7-5-4-6-8-12)17-19-11(2)13(9-10-15(22)23)18(24)21(17)20-14/h4-8,20H,3,9-10H2,1-2H3,(H,22,23)