ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-bromanyl-phenoxy]-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-bromanyl-phenoxy]-2-phenyl-ethanoate Openeye Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-bromo-phenoxy]-2-phenyl-acetate CAS Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromophenoxy]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-bromophenoxy]-2-phenylacetate Traditional Name: 2-[2-(1,3-benzoxazol-2-yl)-4-bromo-phenoxy]-2-phenyl-acetic acid ethyl ester Formula: C23H18BrNO4 MolecularWeight: 452.29732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)OC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)OC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4O3

InChI

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