[1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 5-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 5-chloranyl-2-fluoranyl-benzoate Openeye Name: [1-methyl-2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 5-chloro-2-fluoro-benzoate CAS Name: 5-chloro-2-fluorobenzoic acid [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] 5-chloro-2-fluorobenzoate Traditional Name: 5-chloro-2-fluoro-benzoic acid [2-keto-1-methyl-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C17H21ClFNO3 MolecularWeight: 341.804943

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)OC(=O)C2=C(C=CC(=C2)Cl)F

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)OC(=O)C2=C(C=CC(=C2)Cl)F

InChI

InChI=1S/C17H21ClFNO3/c1-10-5-3-4-6-15(10)20-16(21)11(2)23-17(22)13-9-12(18)7-8-14(13)19/h7-11,15H,3-6H2,1-2H3,(H,20,21)