methyl 4-[[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(4-bromo-2-chloro-6-methyl-phenoxy)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(4-bromo-2-chloro-6-methylphenoxy)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(4-bromo-2-chloro-6-methylphenoxy)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(4-bromo-2-chloro-6-methyl-phenoxy)acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H17BrClNO4 MolecularWeight: 426.68888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NCC2=CC=C(C=C2)C(=O)OC)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NCC2=CC=C(C=C2)C(=O)OC)Cl)Br

InChI

InChI=1S/C18H17BrClNO4/c1-11-7-14(19)8-15(20)17(11)25-10-16(22)21-9-12-3-5-13(6-4-12)18(23)24-2/h3-8H,9-10H2,1-2H3,(H,21,22)