(4Z)-4-[(2-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-2,5-diphenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(2-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-2,5-diphenyl-pyrazol-3-one Openeye Name: (4Z)-4-[(4-allyloxy-2-bromo-5-ethoxy-phenyl)methylene]-2,5-diphenyl-pyrazol-3-one CAS Name: (4Z)-4-[(2-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-2,5-diphenyl-3-pyrazolone IUPAC Name: (4Z)-4-[(2-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methylidene]-2,5-diphenylpyrazol-3-one Traditional Name: (4Z)-4-(4-allyloxy-2-bromo-5-ethoxy-benzylidene)-2,5-diphenyl-2-pyrazolin-3-one Formula: C27H23BrN2O3 MolecularWeight: 503.38712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Br)OCC=C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=C\2/C(=NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Br)OCC=C

InChI

InChI=1S/C27H23BrN2O3/c1-3-15-33-25-18-23(28)20(17-24(25)32-4-2)16-22-26(19-11-7-5-8-12-19)29-30(27(22)31)21-13-9-6-10-14-21/h3,5-14,16-18H,1,4,15H2,2H3/b22-16-