methyl 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]ethanoate Openeye Name: methyl 2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)acetate CAS Name: 2-(4-bromo-3-methyl-N-methylsulfonylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(4-bromo-3-methyl-N-methylsulfonylanilino)acetate Traditional Name: 2-(4-bromo-N-mesyl-3-methyl-anilino)acetic acid methyl ester Formula: C11H14BrNO4S MolecularWeight: 336.20216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC(=O)OC)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC(=O)OC)S(=O)(=O)C)Br

InChI

InChI=1S/C11H14BrNO4S/c1-8-6-9(4-5-10(8)12)13(18(3,15)16)7-11(14)17-2/h4-6H,7H2,1-3H3