1-[[2-chloranyl-2-(4-methylphenyl)ethanoyl]amino]-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[2-chloranyl-2-(4-methylphenyl)ethanoyl]amino]-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-chloro-2-(p-tolyl)acetyl]amino]-3-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-chloro-2-(4-methylphenyl)-1-oxoethyl]amino]-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-chloro-2-(4-methylphenyl)acetyl]amino]-3-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-chloro-2-(p-tolyl)acetyl]amino]-3-methyl-cyclohexanecarboxylic acid Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22ClNO3/c1-11-5-7-13(8-6-11)14(18)15(20)19-17(16(21)22)9-3-4-12(2)10-17/h5-8,12,14H,3-4,9-10H2,1-2H3,(H,19,20)(H,21,22)