methyl 2-[(3-bromophenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[(3-bromophenyl)-methylsulfonyl-amino]ethanoate Openeye Name: methyl 2-(3-bromo-N-methylsulfonyl-anilino)acetate CAS Name: 2-(3-bromo-N-methylsulfonylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(3-bromo-N-methylsulfonylanilino)acetate Traditional Name: 2-(3-bromo-N-mesyl-anilino)acetic acid methyl ester Formula: C10H12BrNO4S MolecularWeight: 322.17558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(C1=CC(=CC=C1)Br)S(=O)(=O)C

Isomeric SMILES

COC(=O)CN(C1=CC(=CC=C1)Br)S(=O)(=O)C

InChI

InChI=1S/C10H12BrNO4S/c1-16-10(13)7-12(17(2,14)15)9-5-3-4-8(11)6-9/h3-6H,7H2,1-2H3