N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-2-(4-bromanylphenoxy)-2-methyl-propanamide

Systemtic Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-2-(4-bromanylphenoxy)-2-methyl-propanamide Openeye Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-2-(4-bromophenoxy)-2-methyl-propanamide CAS Name: N-[4-(2-benzo[e][1,3]benzoxazolyl)phenyl]-2-(4-bromophenoxy)-2-methylpropanamide IUPAC Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-2-(4-bromophenoxy)-2-methylpropanamide Traditional Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-2-(4-bromophenoxy)-2-methyl-propionamide Formula: C27H21BrN2O3 MolecularWeight: 501.37124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=C(C=C1)C2=NC3=C(O2)C=CC4=CC=CC=C43)OC5=CC=C(C=C5)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CC=C(C=C1)C2=NC3=C(O2)C=CC4=CC=CC=C43)OC5=CC=C(C=C5)Br

InChI

InChI=1S/C27H21BrN2O3/c1-27(2,33-21-14-10-19(28)11-15-21)26(31)29-20-12-7-18(8-13-20)25-30-24-22-6-4-3-5-17(22)9-16-23(24)32-25/h3-16H,1-2H3,(H,29,31)