(4Z)-4-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-2,5-diphenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-2,5-diphenyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-2,5-diphenyl-pyrazol-3-one CAS Name: (4Z)-4-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-2,5-diphenyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-2,5-diphenylpyrazol-3-one Traditional Name: (4Z)-2,5-diphenyl-4-[1-(piperonylamino)ethylidene]-2-pyrazolin-3-one Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C/C(=C/1\C(=NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)/NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O3/c1-17(26-15-18-12-13-21-22(14-18)31-16-30-21)23-24(19-8-4-2-5-9-19)27-28(25(23)29)20-10-6-3-7-11-20/h2-14,26H,15-16H2,1H3/b23-17-