4-[(5-bromanylthiophen-3-yl)methoxy]-3-methoxy-benzoic acid

Systemtic Name: 4-[(5-bromanylthiophen-3-yl)methoxy]-3-methoxy-benzoic acid Openeye Name: 4-[(5-bromo-3-thienyl)methoxy]-3-methoxy-benzoic acid CAS Name: 4-[(5-bromo-3-thiophenyl)methoxy]-3-methoxybenzoic acid IUPAC Name: 4-[(5-bromothiophen-3-yl)methoxy]-3-methoxybenzoic acid Traditional Name: 4-[(5-bromo-3-thienyl)methoxy]-3-methoxy-benzoic acid Formula: C13H11BrO4S MolecularWeight: 343.19304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)OCC2=CSC(=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)OCC2=CSC(=C2)Br

InChI

InChI=1S/C13H11BrO4S/c1-17-11-5-9(13(15)16)2-3-10(11)18-6-8-4-12(14)19-7-8/h2-5,7H,6H2,1H3,(H,15,16)