1-[2-(4-chlorophenyl)propanoylamino]-2-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-(4-chlorophenyl)propanoylamino]-2-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(4-chlorophenyl)propanoylamino]-2-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-(4-chlorophenyl)-1-oxopropyl]amino]-2-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(4-chlorophenyl)propanoylamino]-2-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[2-(4-chlorophenyl)propanoylamino]-2-methyl-cyclohexanecarboxylic acid Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1(C(=O)O)NC(=O)C(C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1CCCCC1(C(=O)O)NC(=O)C(C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClNO3/c1-11-5-3-4-10-17(11,16(21)22)19-15(20)12(2)13-6-8-14(18)9-7-13/h6-9,11-12H,3-5,10H2,1-2H3,(H,19,20)(H,21,22)