(4Z)-4-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-[(5-bromo-2-prop-2-ynoxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-[(5-bromo-2-prop-2-ynoxyphenyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-[(5-bromo-2-prop-2-ynoxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4Z)-4-(5-bromo-2-propargyloxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H15BrN2O2 MolecularWeight: 395.2493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Br)OCC#C)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=C(C=CC(=C2)Br)OCC#C)C3=CC=CC=C3

InChI

InChI=1S/C20H15BrN2O2/c1-3-11-25-19-10-9-16(21)12-15(19)13-18-14(2)22-23(20(18)24)17-7-5-4-6-8-17/h1,4-10,12-13H,11H2,2H3/b18-13-