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

Systemtic Name: (Z)-6-[3-[(2-chlorophenyl)carbamoylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (Z)-6-[3-[(2-chlorophenyl)carbamoylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (Z)-6-[3-[[(2-chloroanilino)-oxomethyl]amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (Z)-6-[3-[(2-chlorophenyl)carbamoylamino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (Z)-6-[3-[(2-chlorophenyl)carbamoylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C24H22ClN3O3 MolecularWeight: 435.90278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC2=CC=CC(=C2)C(=CCCCC(=O)O)C3=CN=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC2=CC=CC(=C2)/C(=C/CCCC(=O)O)/C3=CN=CC=C3)Cl

InChI

InChI=1S/C24H22ClN3O3/c25-21-11-2-3-12-22(21)28-24(31)27-19-9-5-7-17(15-19)20(10-1-4-13-23(29)30)18-8-6-14-26-16-18/h2-3,5-12,14-16H,1,4,13H2,(H,29,30)(H2,27,28,31)/b20-10-