[2-(1,3-benzothiazol-2-yl)phenyl] 4-bromanylbenzoate

Systemtic Name: [2-(1,3-benzothiazol-2-yl)phenyl] 4-bromanylbenzoate Openeye Name: [2-(1,3-benzothiazol-2-yl)phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(1,3-benzothiazol-2-yl)phenyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-yl)phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(1,3-benzothiazol-2-yl)phenyl] ester Formula: C20H12BrNO2S MolecularWeight: 410.28378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H12BrNO2S/c21-14-11-9-13(10-12-14)20(23)24-17-7-3-1-5-15(17)19-22-16-6-2-4-8-18(16)25-19/h1-12H