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

Systemtic Name: 3-(5-methyl-7-oxidanylidene-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Openeye Name: 3-(5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid CAS Name: 3-(5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid IUPAC Name: 3-(5-methyl-7-oxo-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propanoic acid Traditional Name: 3-(7-keto-5-methyl-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)propionic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C(=CN2)C3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C16H15N3O3/c1-10-12(7-8-14(20)21)16(22)19-15(18-10)13(9-17-19)11-5-3-2-4-6-11/h2-6,9,17H,7-8H2,1H3,(H,20,21)