3-(5-methyl-7-oxidanidyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate

Systemtic Name: 3-(5-methyl-7-oxidanidyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate Openeye Name: 3-(5-methyl-7-oxido-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate CAS Name: 3-(5-methyl-7-oxido-3-phenyl-6-pyrazolo[1,5-a]pyrimidinyl)propanoate IUPAC Name: 3-(5-methyl-7-oxido-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate Traditional Name: 3-(5-methyl-7-oxido-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propionate Formula: C16H13N3O3-2 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(=C1CCC(=O)[O-])[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(C=NN2C(=C1CCC(=O)[O-])[O-])C3=CC=CC=C3

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/h2-6,9,22H,7-8H2,1H3,(H,20,21)/p-2