3-ethyl-5-[(4-methyl-1-oxidanylidene-phthalazin-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-ethyl-5-[(4-methyl-1-oxidanylidene-phthalazin-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 3-ethyl-5-[(4-methyl-1-oxo-phthalazin-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-ethyl-5-[(4-methyl-1-oxo-2-phthalazinyl)methyl]-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 3-ethyl-5-[(4-methyl-1-oxophthalazin-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 3-ethyl-5-[(1-keto-4-methyl-phthalazin-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-olate Formula: C18H16N5O2- MolecularWeight: 334.35194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2N=C(C=C(N2N=C1)[O-])CN3C(=O)C4=CC=CC=C4C(=N3)C

Isomeric SMILES

CCC1=C2N=C(C=C(N2N=C1)[O-])CN3C(=O)C4=CC=CC=C4C(=N3)C

InChI

InChI=1S/C18H17N5O2/c1-3-12-9-19-23-16(24)8-13(20-17(12)23)10-22-18(25)15-7-5-4-6-14(15)11(2)21-22/h4-9,24H,3,10H2,1-2H3/p-1