1-[2-(4-chloranyl-2-methoxy-phenyl)ethanoylamino]-4-ethyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-(4-chloranyl-2-methoxy-phenyl)ethanoylamino]-4-ethyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-(4-chloro-2-methoxy-phenyl)acetyl]amino]-4-ethyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-(4-chloro-2-methoxyphenyl)-1-oxoethyl]amino]-4-ethyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-(4-chloro-2-methoxyphenyl)acetyl]amino]-4-ethylcyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(4-chloro-2-methoxy-phenyl)acetyl]amino]-4-ethyl-cyclohexanecarboxylic acid Formula: C18H24ClNO4 MolecularWeight: 353.84046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)CC2=C(C=C(C=C2)Cl)OC

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)CC2=C(C=C(C=C2)Cl)OC

InChI

InChI=1S/C18H24ClNO4/c1-3-12-6-8-18(9-7-12,17(22)23)20-16(21)10-13-4-5-14(19)11-15(13)24-2/h4-5,11-12H,3,6-10H2,1-2H3,(H,20,21)(H,22,23)