3-(2,5,7-trimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate

Systemtic Name: 3-(2,5,7-trimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate Openeye Name: 3-(2,5,7-trimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propanoate CAS Name: 3-(2,5,7-trimethyl-3-phenyl-6-pyrazolo[1,5-a]pyrimidinyl)propanoate IUPAC Name: 3-(2,5,7-trimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanoate Traditional Name: 3-(2,5,7-trimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-6-yl)propionate Formula: C18H18N3O2- MolecularWeight: 308.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(C(=NN12)C)C3=CC=CC=C3)C)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=NC2=C(C(=NN12)C)C3=CC=CC=C3)C)CCC(=O)[O-]

InChI

InChI=1S/C18H19N3O2/c1-11-15(9-10-16(22)23)13(3)21-18(19-11)17(12(2)20-21)14-7-5-4-6-8-14/h4-8H,9-10H2,1-3H3,(H,22,23)/p-1