[2,2-bis(fluoranyl)-3-iodanyl-3-(4-methoxyphenyl)imino-1-phenyl-propyl] benzoate

Systemtic Name: [2,2-bis(fluoranyl)-3-iodanyl-3-(4-methoxyphenyl)imino-1-phenyl-propyl] benzoate Openeye Name: [2,2-difluoro-3-iodo-3-(4-methoxyphenyl)imino-1-phenyl-propyl] benzoate CAS Name: benzoic acid [2,2-difluoro-3-iodo-3-(4-methoxyphenyl)imino-1-phenylpropyl] ester IUPAC Name: [2,2-difluoro-3-iodo-3-(4-methoxyphenyl)imino-1-phenylpropyl] benzoate Traditional Name: benzoic acid [2,2-difluoro-3-iodo-3-(4-methoxyphenyl)imino-1-phenyl-propyl] ester Formula: C23H18F2INO3 MolecularWeight: 521.295196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(C(C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)(F)F)I

Isomeric SMILES

COC1=CC=C(C=C1)N=C(C(C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)(F)F)I

InChI

InChI=1S/C23H18F2INO3/c1-29-19-14-12-18(13-15-19)27-22(26)23(24,25)20(16-8-4-2-5-9-16)30-21(28)17-10-6-3-7-11-17/h2-15,20H,1H3