(E)-2-[3-[(3-chlorophenyl)carbonylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (E)-2-[3-[(3-chlorophenyl)carbonylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (E)-2-[3-[(3-chlorobenzoyl)amino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (E)-2-[3-[[(3-chlorophenyl)-oxomethyl]amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (E)-2-[3-[(3-chlorobenzoyl)amino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (E)-2-[3-[(3-chlorobenzoyl)amino]phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C24H21ClN2O3 MolecularWeight: 420.88814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)Cl)C(CCC=CC3=CN=CC=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)Cl)C(CC/C=C/C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C24H21ClN2O3/c25-20-10-3-9-19(14-20)23(28)27-21-11-4-8-18(15-21)22(24(29)30)12-2-1-6-17-7-5-13-26-16-17/h1,3-11,13-16,22H,2,12H2,(H,27,28)(H,29,30)/b6-1+