5-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 5-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-(2-ethoxy-2-oxo-ethyl)-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 5-(2-ethoxy-2-oxoethyl)-2-methyl-3-phenyl-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 5-(2-ethoxy-2-oxoethyl)-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-(2-ethoxy-2-keto-ethyl)-2-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C17H16N3O3- MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC2=C(C(=NN2C(=C1)[O-])C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=NC2=C(C(=NN2C(=C1)[O-])C)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O3/c1-3-23-15(22)10-13-9-14(21)20-17(18-13)16(11(2)19-20)12-7-5-4-6-8-12/h4-9,21H,3,10H2,1-2H3/p-1