[4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] ester IUPAC Name: [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] ester Formula: C27H16BrIN2O3 MolecularWeight: 623.23601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)C=NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)I

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)C=NC3=CC4=C(C=C3)OC(=N4)C5=CC=C(C=C5)I

InChI

InChI=1S/C27H16BrIN2O3/c28-20-3-1-2-19(14-20)27(32)33-23-11-4-17(5-12-23)16-30-22-10-13-25-24(15-22)31-26(34-25)18-6-8-21(29)9-7-18/h1-16H