3-bromanyl-5-ethoxy-4-(4-methoxy-4-oxidanylidene-butoxy)benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-(4-methoxy-4-oxidanylidene-butoxy)benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-(4-methoxy-4-oxo-butoxy)benzoic acid CAS Name: 3-bromo-5-ethoxy-4-(4-methoxy-4-oxobutoxy)benzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-(4-methoxy-4-oxobutoxy)benzoic acid Traditional Name: 3-bromo-5-ethoxy-4-(4-keto-4-methoxy-butoxy)benzoic acid Formula: C14H17BrO6 MolecularWeight: 361.18518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCCCC(=O)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCCCC(=O)OC

InChI

InChI=1S/C14H17BrO6/c1-3-20-11-8-9(14(17)18)7-10(15)13(11)21-6-4-5-12(16)19-2/h7-8H,3-6H2,1-2H3,(H,17,18)