methyl 4-[[(5-bromanyl-2-chloranyl-phenyl)carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(5-bromanyl-2-chloranyl-phenyl)carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(5-bromo-2-chloro-benzoyl)-methyl-amino]methyl]benzoate CAS Name: 4-[[[(5-bromo-2-chlorophenyl)-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(5-bromo-2-chlorobenzoyl)-methylamino]methyl]benzoate Traditional Name: 4-[[(5-bromo-2-chloro-benzoyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C17H15BrClNO3 MolecularWeight: 396.6629

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C17H15BrClNO3/c1-20(16(21)14-9-13(18)7-8-15(14)19)10-11-3-5-12(6-4-11)17(22)23-2/h3-9H,10H2,1-2H3