[(1R)-1-cyanoethyl] 2,4-bis(chloranyl)-5-(2-methylpropylsulfamoyl)benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 2,4-bis(chloranyl)-5-(2-methylpropylsulfamoyl)benzoate Openeye Name: [(1R)-1-cyanoethyl] 2,4-dichloro-5-(isobutylsulfamoyl)benzoate CAS Name: 2,4-dichloro-5-(2-methylpropylsulfamoyl)benzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2,4-dichloro-5-(2-methylpropylsulfamoyl)benzoate Traditional Name: 2,4-dichloro-5-(isobutylsulfamoyl)benzoic acid [(1R)-1-cyanoethyl] ester Formula: C14H16Cl2N2O4S MolecularWeight: 379.25884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=C(C=C(C(=C1)C(=O)OC(C)C#N)Cl)Cl

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)NCC(C)C

InChI

InChI=1S/C14H16Cl2N2O4S/c1-8(2)7-18-23(20,21)13-4-10(11(15)5-12(13)16)14(19)22-9(3)6-17/h4-5,8-9,18H,7H2,1-3H3/t9-/m1/s1