(4E)-3-(1,3-benzodioxol-5-yl)-4-[[(4-methoxyphenyl)amino]methylidene]-1H-pyrazol-5-one

Systemtic Name: (4E)-3-(1,3-benzodioxol-5-yl)-4-[[(4-methoxyphenyl)amino]methylidene]-1H-pyrazol-5-one Openeye Name: (4E)-3-(1,3-benzodioxol-5-yl)-4-[(4-methoxyanilino)methylene]-1H-pyrazol-5-one CAS Name: (4E)-3-(1,3-benzodioxol-5-yl)-4-[(4-methoxyanilino)methylidene]-1H-pyrazol-5-one IUPAC Name: (4E)-3-(1,3-benzodioxol-5-yl)-4-[(4-methoxyanilino)methylidene]-1H-pyrazol-5-one Traditional Name: (4E)-5-(1,3-benzodioxol-5-yl)-4-(p-anisidinomethylene)-2-pyrazolin-3-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC=C2C(=NNC2=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)N/C=C/2\C(=NNC2=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O4/c1-23-13-5-3-12(4-6-13)19-9-14-17(20-21-18(14)22)11-2-7-15-16(8-11)25-10-24-15/h2-9,19H,10H2,1H3,(H,21,22)/b14-9+