methyl 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-4-methylpentanoate Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C13H17ClFNO4S MolecularWeight: 337.794783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClFNO4S/c1-8(2)6-12(13(17)20-3)16-21(18,19)9-4-5-11(15)10(14)7-9/h4-5,7-8,12,16H,6H2,1-3H3