(E)-3-(5-bromanyl-2-propoxy-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-propoxy-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-propoxy-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-propoxyphenyl)-1-(1,3,5-trimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-propoxyphenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-propoxy-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Formula: C18H21BrN2O2 MolecularWeight: 377.27554

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C=CC(=O)C2=C(N(N=C2C)C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)/C=C/C(=O)C2=C(N(N=C2C)C)C

InChI

InChI=1S/C18H21BrN2O2/c1-5-10-23-17-9-7-15(19)11-14(17)6-8-16(22)18-12(2)20-21(4)13(18)3/h6-9,11H,5,10H2,1-4H3/b8-6+