methyl 4-[[[(2-bromanyl-4-fluoranyl-phenyl)amino]carbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[(2-bromanyl-4-fluoranyl-phenyl)amino]carbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[(2-bromo-4-fluoro-anilino)carbamoylamino]methyl]benzoate CAS Name: 4-[[[[(2-bromo-4-fluorophenyl)hydrazo]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-bromo-4-fluoroanilino)carbamoylamino]methyl]benzoate Traditional Name: 4-[[(2-bromo-4-fluoro-anilino)carbamoylamino]methyl]benzoic acid methyl ester Formula: C16H15BrFN3O3 MolecularWeight: 396.211003

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NNC2=C(C=C(C=C2)F)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NNC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C16H15BrFN3O3/c1-24-15(22)11-4-2-10(3-5-11)9-19-16(23)21-20-14-7-6-12(18)8-13(14)17/h2-8,20H,9H2,1H3,(H2,19,21,23)