3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]propanoate

Systemtic Name: 3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]propanoate Openeye Name: 3-[2-(3-bromophenyl)thiazol-4-yl]propanoate CAS Name: 3-[2-(3-bromophenyl)-4-thiazolyl]propanoate IUPAC Name: 3-[2-(3-bromophenyl)-1,3-thiazol-4-yl]propanoate Traditional Name: 3-[2-(3-bromophenyl)thiazol-4-yl]propionate Formula: C12H9BrNO2S- MolecularWeight: 311.17436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NC(=CS2)CCC(=O)[O-]

InChI

InChI=1S/C12H10BrNO2S/c13-9-3-1-2-8(6-9)12-14-10(7-17-12)4-5-11(15)16/h1-3,6-7H,4-5H2,(H,15,16)/p-1