(E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(1-ethyl-5-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(1-ethyl-5-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-1-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one Formula: C16H17BrN2O3 MolecularWeight: 365.22178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C(=O)C=CC2=CC(=C(C(=C2)Br)O)OC)C

Isomeric SMILES

CCN1C(=C(C=N1)C(=O)/C=C/C2=CC(=C(C(=C2)Br)O)OC)C

InChI

InChI=1S/C16H17BrN2O3/c1-4-19-10(2)12(9-18-19)14(20)6-5-11-7-13(17)16(21)15(8-11)22-3/h5-9,21H,4H2,1-3H3/b6-5+