[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H18BrFN2O4 MolecularWeight: 389.216823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)Br)F

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C15H18BrFN2O4/c1-9(2)5-6-18-15(22)19-13(20)8-23-14(21)11-7-10(16)3-4-12(11)17/h3-4,7,9H,5-6,8H2,1-2H3,(H2,18,19,20,22)