4-[(Z)-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylhydrazinylidene]methyl]-5-methyl-2-phenyl-pyrazol-3-olate

Systemtic Name: 4-[(Z)-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylhydrazinylidene]methyl]-5-methyl-2-phenyl-pyrazol-3-olate Openeye Name: 4-[(Z)-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]hydrazono]methyl]-5-methyl-2-phenyl-pyrazol-3-olate CAS Name: 4-[(Z)-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]hydrazinylidene]methyl]-5-methyl-2-phenyl-3-pyrazololate IUPAC Name: 4-[(Z)-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]hydrazinylidene]methyl]-5-methyl-2-phenylpyrazol-3-olate Traditional Name: 4-[(Z)-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]hydrazono]methyl]-5-methyl-2-phenyl-pyrazol-3-olate Formula: C20H17N4O4- MolecularWeight: 377.37338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2COC3=CC=CC=C3O2)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N\NC(=O)[C@H]2COC3=CC=CC=C3O2)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H18N4O4/c1-13-15(20(26)24(23-13)14-7-3-2-4-8-14)11-21-22-19(25)18-12-27-16-9-5-6-10-17(16)28-18/h2-11,18,26H,12H2,1H3,(H,22,25)/p-1/b21-11-/t18-/m1/s1