1-[[2-chloranyl-2-(2-fluorophenyl)ethanoyl]amino]-4-ethyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[2-chloranyl-2-(2-fluorophenyl)ethanoyl]amino]-4-ethyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-4-ethyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-chloro-2-(2-fluorophenyl)-1-oxoethyl]amino]-4-ethyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-4-ethylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-4-ethyl-cyclohexanecarboxylic acid Formula: C17H21ClFNO3 MolecularWeight: 341.804943

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)C(C2=CC=CC=C2F)Cl

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)C(C2=CC=CC=C2F)Cl

InChI

InChI=1S/C17H21ClFNO3/c1-2-11-7-9-17(10-8-11,16(22)23)20-15(21)14(18)12-5-3-4-6-13(12)19/h3-6,11,14H,2,7-10H2,1H3,(H,20,21)(H,22,23)