methyl 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-chlorophenyl)sulfonylamino]-4-methylpentanoate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C13H17BrClNO4S MolecularWeight: 398.70038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrClNO4S/c1-8(2)6-11(13(17)20-3)16-21(18,19)12-5-4-9(14)7-10(12)15/h4-5,7-8,11,16H,6H2,1-3H3