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

Systemtic Name: 1-[[2-chloranyl-2-(4-methoxyphenyl)ethanoyl]amino]-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-chloro-2-(4-methoxyphenyl)acetyl]amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-chloro-2-(4-methoxyphenyl)-1-oxoethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-chloro-2-(4-methoxyphenyl)acetyl]amino]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-chloro-2-(4-methoxyphenyl)acetyl]amino]-4-methyl-cyclohexanecarboxylic acid Formula: C17H22ClNO4 MolecularWeight: 339.81388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C(C2=CC=C(C=C2)OC)Cl

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C(C2=CC=C(C=C2)OC)Cl

InChI

InChI=1S/C17H22ClNO4/c1-11-7-9-17(10-8-11,16(21)22)19-15(20)14(18)12-3-5-13(23-2)6-4-12/h3-6,11,14H,7-10H2,1-2H3,(H,19,20)(H,21,22)