3-bromanyl-5-ethoxy-4-(thiophen-2-ylmethoxy)benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-(thiophen-2-ylmethoxy)benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-(2-thienylmethoxy)benzoic acid CAS Name: 3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)benzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)benzoic acid Traditional Name: 3-bromo-5-ethoxy-4-(2-thenyloxy)benzoic acid Formula: C14H13BrO4S MolecularWeight: 357.21962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC2=CC=CS2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC2=CC=CS2

InChI

InChI=1S/C14H13BrO4S/c1-2-18-12-7-9(14(16)17)6-11(15)13(12)19-8-10-4-3-5-20-10/h3-7H,2,8H2,1H3,(H,16,17)