3-[4-[2-[(5-chloranyl-2-pentoxy-phenyl)carbonylamino]ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(5-chloranyl-2-pentoxy-phenyl)carbonylamino]ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(5-chloro-2-pentoxy-benzoyl)amino]ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[(5-chloro-2-pentoxyphenyl)-oxomethyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(5-chloro-2-pentoxybenzoyl)amino]ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[(2-amoxy-5-chloro-benzoyl)amino]ethyl]phenyl]propionic acid Formula: C23H28ClNO4 MolecularWeight: 417.92572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C23H28ClNO4/c1-2-3-4-15-29-21-11-10-19(24)16-20(21)23(28)25-14-13-18-7-5-17(6-8-18)9-12-22(26)27/h5-8,10-11,16H,2-4,9,12-15H2,1H3,(H,25,28)(H,26,27)