methyl 2-[[3-(bromomethyl)phenyl]-ethanoyl-amino]-4-chloranyl-benzoate

Systemtic Name: methyl 2-[[3-(bromomethyl)phenyl]-ethanoyl-amino]-4-chloranyl-benzoate Openeye Name: methyl 2-[N-acetyl-3-(bromomethyl)anilino]-4-chloro-benzoate CAS Name: 2-[N-acetyl-3-(bromomethyl)anilino]-4-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-[N-acetyl-3-(bromomethyl)anilino]-4-chlorobenzoate Traditional Name: 2-[N-acetyl-3-(bromomethyl)anilino]-4-chloro-benzoic acid methyl ester Formula: C17H15BrClNO3 MolecularWeight: 396.6629

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC(=C1)CBr)C2=C(C=CC(=C2)Cl)C(=O)OC

Isomeric SMILES

CC(=O)N(C1=CC=CC(=C1)CBr)C2=C(C=CC(=C2)Cl)C(=O)OC

InChI

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