[4-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]phenyl] 4-methylbenzoate Openeye Name: [4-[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]phenyl] ester Formula: C23H16ClFO3 MolecularWeight: 394.822743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C=CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)/C=C/C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H16ClFO3/c1-15-5-7-17(8-6-15)23(27)28-18-11-9-16(10-12-18)22(26)14-13-19-20(24)3-2-4-21(19)25/h2-14H,1H3/b14-13+