(E)-3-(5-bromanyl-2-methoxy-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-1-(1-methyl-3-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-1-(1-methylpyrazol-3-yl)prop-2-en-1-one Formula: C14H13BrN2O2 MolecularWeight: 321.16922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)C=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN2O2/c1-17-8-7-12(16-17)13(18)5-3-10-9-11(15)4-6-14(10)19-2/h3-9H,1-2H3/b5-3+