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

Systemtic Name: 1-[2-(2-methoxy-4-methyl-phenyl)propanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(2-methoxy-4-methyl-phenyl)propanoylamino]cyclohexanecarboxylic acid CAS Name: 1-[[2-(2-methoxy-4-methylphenyl)-1-oxopropyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(2-methoxy-4-methylphenyl)propanoylamino]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(2-methoxy-4-methyl-phenyl)propanoylamino]cyclohexanecarboxylic acid Formula: C18H25NO4 MolecularWeight: 319.3954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C(=O)NC2(CCCCC2)C(=O)O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C(=O)NC2(CCCCC2)C(=O)O)OC

InChI

InChI=1S/C18H25NO4/c1-12-7-8-14(15(11-12)23-3)13(2)16(20)19-18(17(21)22)9-5-4-6-10-18/h7-8,11,13H,4-6,9-10H2,1-3H3,(H,19,20)(H,21,22)