[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: [4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] 2-(4-bromanylphenoxy)ethanoate Openeye Name: [4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid [4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] ester IUPAC Name: [4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid [4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl] ester Formula: C23H18BrNO4 MolecularWeight: 452.29732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)OC(=O)COC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)OC(=O)COC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H18BrNO4/c1-14-11-15(2)22-20(12-14)25-23(29-22)16-3-7-19(8-4-16)28-21(26)13-27-18-9-5-17(24)6-10-18/h3-12H,13H2,1-2H3