3-[3-acetamido-4-(propylcarbamoyloxy)phenyl]-2-[(2-chlorophenyl)carbonylamino]propanoic acid

Systemtic Name: 3-[3-acetamido-4-(propylcarbamoyloxy)phenyl]-2-[(2-chlorophenyl)carbonylamino]propanoic acid Openeye Name: 3-[3-acetamido-4-(propylcarbamoyloxy)phenyl]-2-[(2-chlorobenzoyl)amino]propanoic acid CAS Name: 3-[3-acetamido-4-[oxo(propylamino)methoxy]phenyl]-2-[[(2-chlorophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[3-acetamido-4-(propylcarbamoyloxy)phenyl]-2-[(2-chlorobenzoyl)amino]propanoic acid Traditional Name: 3-[3-acetamido-4-(propylcarbamoyloxy)phenyl]-2-[(2-chlorobenzoyl)amino]propionic acid Formula: C22H24ClN3O6 MolecularWeight: 461.89546

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)OC1=C(C=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2Cl)NC(=O)C

Isomeric SMILES

CCCNC(=O)OC1=C(C=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2Cl)NC(=O)C

InChI

InChI=1S/C22H24ClN3O6/c1-3-10-24-22(31)32-19-9-8-14(11-17(19)25-13(2)27)12-18(21(29)30)26-20(28)15-6-4-5-7-16(15)23/h4-9,11,18H,3,10,12H2,1-2H3,(H,24,31)(H,25,27)(H,26,28)(H,29,30)