2-[(4-chlorophenyl)sulfonyl-[(4-fluorophenyl)methyl]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-[(4-fluorophenyl)methyl]amino]cyclohexane-1-carboxylic acid Openeye Name: 2-[(4-chlorophenyl)sulfonyl-[(4-fluorophenyl)methyl]amino]cyclohexanecarboxylic acid CAS Name: 2-[(4-chlorophenyl)sulfonyl-[(4-fluorophenyl)methyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(4-chlorophenyl)sulfonyl-[(4-fluorophenyl)methyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 2-[(4-chlorophenyl)sulfonyl-(4-fluorobenzyl)amino]cyclohexanecarboxylic acid Formula: C20H21ClFNO4S MolecularWeight: 425.901443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)N(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(C(C1)C(=O)O)N(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClFNO4S/c21-15-7-11-17(12-8-15)28(26,27)23(13-14-5-9-16(22)10-6-14)19-4-2-1-3-18(19)20(24)25/h5-12,18-19H,1-4,13H2,(H,24,25)