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

Systemtic Name: methyl 2-[2-(1,3-benzoxazol-2-yl)-4-bromanyl-phenoxy]-2-phenyl-ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C22H16BrNO4 MolecularWeight: 438.27074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16BrNO4/c1-26-22(25)20(14-7-3-2-4-8-14)27-18-12-11-15(23)13-16(18)21-24-17-9-5-6-10-19(17)28-21/h2-13,20H,1H3