1-[2-[2,6-bis(chloranyl)phenyl]ethanoylamino]-4-tert-butyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[2,6-bis(chloranyl)phenyl]ethanoylamino]-4-tert-butyl-cyclohexane-1-carboxylic acid Openeye Name: 4-tert-butyl-1-[[2-(2,6-dichlorophenyl)acetyl]amino]cyclohexanecarboxylic acid CAS Name: 4-tert-butyl-1-[[2-(2,6-dichlorophenyl)-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-tert-butyl-1-[[2-(2,6-dichlorophenyl)acetyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-tert-butyl-1-[[2-(2,6-dichlorophenyl)acetyl]amino]cyclohexanecarboxylic acid Formula: C19H25Cl2NO3 MolecularWeight: 386.3127

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)(C(=O)O)NC(=O)CC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CC(C)(C)C1CCC(CC1)(C(=O)O)NC(=O)CC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C19H25Cl2NO3/c1-18(2,3)12-7-9-19(10-8-12,17(24)25)22-16(23)11-13-14(20)5-4-6-15(13)21/h4-6,12H,7-11H2,1-3H3,(H,22,23)(H,24,25)