(E)-1-(3-bromanyl-4-methoxy-phenyl)-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(3-bromanyl-4-methoxy-phenyl)-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(3-bromo-4-methoxy-phenyl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(3-bromo-4-methoxyphenyl)-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(3-bromo-4-methoxyphenyl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(3-bromo-4-methoxy-phenyl)-3-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]prop-2-en-1-one Formula: C26H21BrN2O2 MolecularWeight: 473.36114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2/C=C/C(=O)C3=CC(=C(C=C3)OC)Br)C4=CC=CC=C4

InChI

InChI=1S/C26H21BrN2O2/c1-18-8-10-19(11-9-18)26-21(17-29(28-26)22-6-4-3-5-7-22)12-14-24(30)20-13-15-25(31-2)23(27)16-20/h3-17H,1-2H3/b14-12+