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

Systemtic Name: methyl 2-[(4-bromanyl-3-methyl-phenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(4-bromo-3-methyl-phenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-bromo-3-methylphenyl)sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-3-methylphenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-bromo-3-methyl-phenyl)sulfonyl-methyl-amino]acetic acid methyl ester Formula: C11H14BrNO4S MolecularWeight: 336.20216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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