2-ethyl-2-[[1-(2-phenoxyethoxy)naphthalen-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 2-ethyl-2-[[1-(2-phenoxyethoxy)naphthalen-2-yl]carbonylamino]hexanoic acid Openeye Name: 2-ethyl-2-[[1-(2-phenoxyethoxy)naphthalene-2-carbonyl]amino]hexanoic acid CAS Name: 2-ethyl-2-[[oxo-[1-(2-phenoxyethoxy)-2-naphthalenyl]methyl]amino]hexanoic acid IUPAC Name: 2-ethyl-2-[[1-(2-phenoxyethoxy)naphthalene-2-carbonyl]amino]hexanoic acid Traditional Name: 2-ethyl-2-[[1-(2-phenoxyethoxy)-2-naphthoyl]amino]hexanoic acid Formula: C27H31NO5 MolecularWeight: 449.53874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCOC3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H31NO5/c1-3-5-17-27(4-2,26(30)31)28-25(29)23-16-15-20-11-9-10-14-22(20)24(23)33-19-18-32-21-12-7-6-8-13-21/h6-16H,3-5,17-19H2,1-2H3,(H,28,29)(H,30,31)