methyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexyl-propanoate

Systemtic Name: methyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexyl-propanoate Openeye Name: methyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexyl-propanoate CAS Name: 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexylpropanoate Traditional Name: 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-3-cyclohexyl-propionic acid methyl ester Formula: C17H21ClF3NO4S MolecularWeight: 427.86615

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCC1)NS(=O)(=O)C2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

COC(=O)C(CC1CCCCC1)NS(=O)(=O)C2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C17H21ClF3NO4S/c1-26-16(23)14(9-11-5-3-2-4-6-11)22-27(24,25)15-10-12(17(19,20)21)7-8-13(15)18/h7-8,10-11,14,22H,2-6,9H2,1H3