1-[2-(4-methoxyphenyl)propanoylamino]-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-(4-methoxyphenyl)propanoylamino]-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(4-methoxyphenyl)propanoylamino]-3-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-(4-methoxyphenyl)-1-oxopropyl]amino]-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(4-methoxyphenyl)propanoylamino]-3-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[2-(4-methoxyphenyl)propanoylamino]-3-methyl-cyclohexanecarboxylic acid Formula: C18H25NO4 MolecularWeight: 319.3954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO4/c1-12-5-4-10-18(11-12,17(21)22)19-16(20)13(2)14-6-8-15(23-3)9-7-14/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,19,20)(H,21,22)