(E)-3-(5-bromanyl-2-propoxy-phenyl)-1-(2,5-dimethylpyrazol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-propoxy-phenyl)-1-(2,5-dimethylpyrazol-3-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-propoxy-phenyl)-1-(2,5-dimethylpyrazol-3-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-propoxyphenyl)-1-(2,5-dimethyl-3-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-propoxyphenyl)-1-(2,5-dimethylpyrazol-3-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-propoxy-phenyl)-1-(2,5-dimethylpyrazol-3-yl)prop-2-en-1-one Formula: C17H19BrN2O2 MolecularWeight: 363.24896

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C=CC(=O)C2=CC(=NN2C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)/C=C/C(=O)C2=CC(=NN2C)C

InChI

InChI=1S/C17H19BrN2O2/c1-4-9-22-17-8-6-14(18)11-13(17)5-7-16(21)15-10-12(2)19-20(15)3/h5-8,10-11H,4,9H2,1-3H3/b7-5+