butyl 4-[(5-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]benzoate

Systemtic Name: butyl 4-[(5-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]benzoate Openeye Name: butyl 4-[(5-bromo-2-fluoro-phenyl)methylcarbamoylamino]benzoate CAS Name: 4-[[[(5-bromo-2-fluorophenyl)methylamino]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(5-bromo-2-fluorophenyl)methylcarbamoylamino]benzoate Traditional Name: 4-[(5-bromo-2-fluoro-benzyl)carbamoylamino]benzoic acid butyl ester Formula: C19H20BrFN2O3 MolecularWeight: 423.276103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C19H20BrFN2O3/c1-2-3-10-26-18(24)13-4-7-16(8-5-13)23-19(25)22-12-14-11-15(20)6-9-17(14)21/h4-9,11H,2-3,10,12H2,1H3,(H2,22,23,25)