(4E)-2-(3-bromophenyl)-4-[(4-cyclopentyloxy-3-ethoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: (4E)-2-(3-bromophenyl)-4-[(4-cyclopentyloxy-3-ethoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one Openeye Name: (4E)-2-(3-bromophenyl)-4-[[4-(cyclopentoxy)-3-ethoxy-phenyl]methylene]-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3-bromophenyl)-4-[(4-cyclopentyloxy-3-ethoxyphenyl)methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(3-bromophenyl)-4-[(4-cyclopentyloxy-3-ethoxyphenyl)methylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-2-(3-bromophenyl)-4-[4-(cyclopentoxy)-3-ethoxy-benzylidene]-5-methyl-2-pyrazolin-3-one Formula: C24H25BrN2O3 MolecularWeight: 469.3709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC(=CC=C3)Br)C)OC4CCCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=NN(C2=O)C3=CC(=CC=C3)Br)C)OC4CCCC4

InChI

InChI=1S/C24H25BrN2O3/c1-3-29-23-14-17(11-12-22(23)30-20-9-4-5-10-20)13-21-16(2)26-27(24(21)28)19-8-6-7-18(25)15-19/h6-8,11-15,20H,3-5,9-10H2,1-2H3/b21-13+