4-[(S)-(2-ethoxyphenyl)-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate

Systemtic Name: 4-[(S)-(2-ethoxyphenyl)-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate Openeye Name: 4-[(S)-(2-ethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate CAS Name: 4-[(S)-(2-ethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate IUPAC Name: 4-[(S)-(2-ethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1H-pyrazol-3-olate Traditional Name: 4-[(S)-(3-keto-5-methyl-3-pyrazolin-4-yl)-o-phenetyl-methyl]-5-methyl-1H-pyrazol-3-olate Formula: C17H19N4O3- MolecularWeight: 327.35776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2=C(NNC2=O)C)C3=C(NN=C3[O-])C

Isomeric SMILES

CCOC1=CC=CC=C1[C@H](C2=C(NNC2=O)C)C3=C(NN=C3[O-])C

InChI

InChI=1S/C17H20N4O3/c1-4-24-12-8-6-5-7-11(12)15(13-9(2)18-20-16(13)22)14-10(3)19-21-17(14)23/h5-8,15H,4H2,1-3H3,(H2,18,20,22)(H2,19,21,23)/p-1