(E)-1-(3-bromophenyl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(3-bromophenyl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(3-bromophenyl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(3-bromophenyl)-3-(1-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(3-bromophenyl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(3-bromophenyl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Formula: C13H11BrN2O MolecularWeight: 291.14324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C13H11BrN2O/c1-16-9-10(8-15-16)5-6-13(17)11-3-2-4-12(14)7-11/h2-9H,1H3/b6-5+