[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H14BrFN2O3 MolecularWeight: 381.196363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)N)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)N)F

InChI

InChI=1S/C16H14BrFN2O3/c17-11-3-6-14(19)13(7-11)16(22)23-9-15(21)20-8-10-1-4-12(18)5-2-10/h1-7H,8-9,19H2,(H,20,21)