1,3-benzothiazol-2-ylmethyl 4-bromanylbenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-bromanylbenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C15H10BrNO2S MolecularWeight: 348.2144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H10BrNO2S/c16-11-7-5-10(6-8-11)15(18)19-9-14-17-12-3-1-2-4-13(12)20-14/h1-8H,9H2