2-[(5-bromanyl-2-ethoxy-phenyl)-oxidanyl-methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(5-bromanyl-2-ethoxy-phenyl)-oxidanyl-methyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[(5-bromo-2-ethoxy-phenyl)-hydroxy-methyl]cyclohexanecarboxylic acid CAS Name: 2-[(5-bromo-2-ethoxyphenyl)-hydroxymethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(5-bromo-2-ethoxyphenyl)-hydroxymethyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[(5-bromo-2-ethoxy-phenyl)-hydroxy-methyl]cyclohexanecarboxylic acid Formula: C16H21BrO4 MolecularWeight: 357.23954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(C2CCCCC2C(=O)O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(C2CCCCC2C(=O)O)O

InChI

InChI=1S/C16H21BrO4/c1-2-21-14-8-7-10(17)9-13(14)15(18)11-5-3-4-6-12(11)16(19)20/h7-9,11-12,15,18H,2-6H2,1H3,(H,19,20)