(E)-1-(3-bromanyl-4-methoxy-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(3-bromanyl-4-methoxy-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(3-bromo-4-methoxy-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(3-bromo-4-methoxyphenyl)-3-(1,3-diphenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(3-bromo-4-methoxyphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(3-bromo-4-methoxy-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one Formula: C25H19BrN2O2 MolecularWeight: 459.33456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C25H19BrN2O2/c1-30-24-15-13-19(16-22(24)26)23(29)14-12-20-17-28(21-10-6-3-7-11-21)27-25(20)18-8-4-2-5-9-18/h2-17H,1H3/b14-12+