[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 2-(4-bromanylphenoxy)ethanoate Openeye Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] ester IUPAC Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] ester Formula: C22H16BrNO3S MolecularWeight: 454.33634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)OC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)OC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrNO3S/c1-14-2-11-19-20(12-14)28-22(24-19)15-3-7-18(8-4-15)27-21(25)13-26-17-9-5-16(23)6-10-17/h2-12H,13H2,1H3