2-[3-(4-ethylphenyl)propanoylamino]hexanoic acid

Systemtic Name: 2-[3-(4-ethylphenyl)propanoylamino]hexanoic acid Openeye Name: 2-[3-(4-ethylphenyl)propanoylamino]hexanoic acid CAS Name: 2-[[3-(4-ethylphenyl)-1-oxopropyl]amino]hexanoic acid IUPAC Name: 2-[3-(4-ethylphenyl)propanoylamino]hexanoic acid Traditional Name: 2-[3-(4-ethylphenyl)propanoylamino]hexanoic acid Formula: C17H25NO3 MolecularWeight: 291.3853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CCC1=CC=C(C=C1)CC

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CCC1=CC=C(C=C1)CC

InChI

InChI=1S/C17H25NO3/c1-3-5-6-15(17(20)21)18-16(19)12-11-14-9-7-13(4-2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3,(H,18,19)(H,20,21)