methyl 6-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]hexanoate

Systemtic Name: methyl 6-[(4-bromanyl-2-fluoranyl-phenyl)carbamoylamino]hexanoate Openeye Name: methyl 6-[(4-bromo-2-fluoro-phenyl)carbamoylamino]hexanoate CAS Name: 6-[[(4-bromo-2-fluoroanilino)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-bromo-2-fluorophenyl)carbamoylamino]hexanoate Traditional Name: 6-[(4-bromo-2-fluoro-phenyl)carbamoylamino]hexanoic acid methyl ester Formula: C14H18BrFN2O3 MolecularWeight: 361.206723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

COC(=O)CCCCCNC(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C14H18BrFN2O3/c1-21-13(19)5-3-2-4-8-17-14(20)18-12-7-6-10(15)9-11(12)16/h6-7,9H,2-5,8H2,1H3,(H2,17,18,20)