[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H12BrCl2NO3 MolecularWeight: 417.08138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)Br)Cl)Cl

InChI

InChI=1S/C16H12BrCl2NO3/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,8-9H2,(H,20,21)