[2-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-fluoranylbenzoate

Systemtic Name: [2-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] 4-fluoranylbenzoate Openeye Name: [2-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [2-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C22H14BrFO3 MolecularWeight: 425.247163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H14BrFO3/c23-18-10-5-15(6-11-18)20(25)14-9-16-3-1-2-4-21(16)27-22(26)17-7-12-19(24)13-8-17/h1-14H/b14-9+