N-[(E)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[(E)-(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[(E)-(2,4-dimethyl-5-oxo-1-phenyl-pyrazol-3-yl)methyleneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[(E)-(2,4-dimethyl-5-oxo-1-phenyl-3-pyrazolyl)methylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[(E)-(2,4-dimethyl-5-oxo-1-phenylpyrazol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[(E)-(5-keto-2,4-dimethyl-1-phenyl-3-pyrazolin-3-yl)methyleneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)C=NNC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)/C=N/NC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H20N4O4/c1-14-16(24(2)25(21(14)27)15-8-4-3-5-9-15)12-22-23-20(26)19-13-28-17-10-6-7-11-18(17)29-19/h3-12,19H,13H2,1-2H3,(H,23,26)/b22-12+