[2-[(2-methylcyclohexyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-bromanyl-4-fluoranyl-benzoate

Systemtic Name: [2-[(2-methylcyclohexyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-bromanyl-4-fluoranyl-benzoate Openeye Name: [2-[(2-methylcyclohexyl)carbamoylamino]-2-oxo-ethyl] 2-bromo-4-fluoro-benzoate CAS Name: 2-bromo-4-fluorobenzoic acid [2-[[[(2-methylcyclohexyl)amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)carbamoylamino]-2-oxoethyl] 2-bromo-4-fluorobenzoate Traditional Name: 2-bromo-4-fluoro-benzoic acid [2-keto-2-[(2-methylcyclohexyl)carbamoylamino]ethyl] ester Formula: C17H20BrFN2O4 MolecularWeight: 415.254103

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC1CCCCC1NC(=O)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C17H20BrFN2O4/c1-10-4-2-3-5-14(10)20-17(24)21-15(22)9-25-16(23)12-7-6-11(19)8-13(12)18/h6-8,10,14H,2-5,9H2,1H3,(H2,20,21,22,24)