1-[2-[(3-bromanyl-5-fluoranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(3-bromanyl-5-fluoranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(3-bromo-5-fluoro-2-methoxy-anilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-(3-bromo-5-fluoro-2-methoxyanilino)-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(3-bromo-5-fluoro-2-methoxyanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(3-bromo-5-fluoro-2-methoxy-anilino)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C16H19BrFNO4 MolecularWeight: 388.228763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1NC(=O)CC2(CCCCC2)C(=O)O)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1NC(=O)CC2(CCCCC2)C(=O)O)F)Br

InChI

InChI=1S/C16H19BrFNO4/c1-23-14-11(17)7-10(18)8-12(14)19-13(20)9-16(15(21)22)5-3-2-4-6-16/h7-8H,2-6,9H2,1H3,(H,19,20)(H,21,22)