methyl 2-[(3-bromophenyl)sulfonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(3-bromophenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(3-bromophenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[(3-bromophenyl)sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-bromophenyl)sulfonylamino]-4-methylpentanoate Traditional Name: 2-[(3-bromophenyl)sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C13H18BrNO4S MolecularWeight: 364.25532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NS(=O)(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)CC(C(=O)OC)NS(=O)(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C13H18BrNO4S/c1-9(2)7-12(13(16)19-3)15-20(17,18)11-6-4-5-10(14)8-11/h4-6,8-9,12,15H,7H2,1-3H3