2-(4-chlorophenyl)-4-[2-(2-methylpropanoyloxy)ethoxycarbonylamino]butanoic acid

Systemtic Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropanoyloxy)ethoxycarbonylamino]butanoic acid Openeye Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropanoyloxy)ethoxycarbonylamino]butanoic acid CAS Name: 2-(4-chlorophenyl)-4-[[2-(2-methyl-1-oxopropoxy)ethoxy-oxomethyl]amino]butanoic acid IUPAC Name: 2-(4-chlorophenyl)-4-[2-(2-methylpropanoyloxy)ethoxycarbonylamino]butanoic acid Traditional Name: 2-(4-chlorophenyl)-4-(2-isobutyryloxyethoxycarbonylamino)butyric acid Formula: C17H22ClNO6 MolecularWeight: 371.81268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCCOC(=O)NCCC(C1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CC(C)C(=O)OCCOC(=O)NCCC(C1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C17H22ClNO6/c1-11(2)16(22)24-9-10-25-17(23)19-8-7-14(15(20)21)12-3-5-13(18)6-4-12/h3-6,11,14H,7-10H2,1-2H3,(H,19,23)(H,20,21)