methyl 5-(3-cyclohexylpropanoylamino)-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-(3-cyclohexylpropanoylamino)-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-(3-cyclohexylpropanoylamino)-2,4-difluoro-benzoate CAS Name: 5-[(3-cyclohexyl-1-oxopropyl)amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-(3-cyclohexylpropanoylamino)-2,4-difluorobenzoate Traditional Name: 5-(3-cyclohexylpropanoylamino)-2,4-difluoro-benzoic acid methyl ester Formula: C17H21F2NO3 MolecularWeight: 325.350346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCC2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C17H21F2NO3/c1-23-17(22)12-9-15(14(19)10-13(12)18)20-16(21)8-7-11-5-3-2-4-6-11/h9-11H,2-8H2,1H3,(H,20,21)