(E)-3-(4-bromanyl-2-fluoranyl-phenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-bromanyl-2-fluoranyl-phenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Openeye Name: (E)-3-(4-bromo-2-fluoro-phenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one CAS Name: (E)-3-(4-bromo-2-fluorophenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)-2-propen-1-one IUPAC Name: (E)-3-(4-bromo-2-fluorophenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Traditional Name: (E)-3-(4-bromo-2-fluoro-phenyl)-1-cyclopentyl-2-(1,2,4-triazol-1-ylmethyl)prop-2-en-1-one Formula: C17H12BrFN3O MolecularWeight: 373.199083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)C=C(CN2C=NC=N2)C(=O)[C]3[CH][CH][CH][CH]3

Isomeric SMILES

C1=CC(=C(C=C1Br)F)/C=C(\CN2C=NC=N2)/C(=O)[C]3[CH][CH][CH][CH]3

InChI

InChI=1S/C17H12BrFN3O/c18-15-6-5-13(16(19)8-15)7-14(9-22-11-20-10-21-22)17(23)12-3-1-2-4-12/h1-8,10-11H,9H2/b14-7+