1-[[2-chloranyl-2-(2-fluorophenyl)ethanoyl]amino]-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[2-chloranyl-2-(2-fluorophenyl)ethanoyl]amino]-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-3-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-chloro-2-(2-fluorophenyl)-1-oxoethyl]amino]-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-3-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-chloro-2-(2-fluorophenyl)acetyl]amino]-3-methyl-cyclohexanecarboxylic acid Formula: C16H19ClFNO3 MolecularWeight: 327.778363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C(=O)O)NC(=O)C(C2=CC=CC=C2F)Cl

Isomeric SMILES

CC1CCCC(C1)(C(=O)O)NC(=O)C(C2=CC=CC=C2F)Cl

InChI

InChI=1S/C16H19ClFNO3/c1-10-5-4-8-16(9-10,15(21)22)19-14(20)13(17)11-6-2-3-7-12(11)18/h2-3,6-7,10,13H,4-5,8-9H2,1H3,(H,19,20)(H,21,22)