2-(ethoxycarbonylamino)-3-[4-[3-(pyridin-3-ylcarbamoylamino)phenyl]phenyl]propanoic acid

Systemtic Name: 2-(ethoxycarbonylamino)-3-[4-[3-(pyridin-3-ylcarbamoylamino)phenyl]phenyl]propanoic acid Openeye Name: 2-(ethoxycarbonylamino)-3-[4-[3-(3-pyridylcarbamoylamino)phenyl]phenyl]propanoic acid CAS Name: 2-(ethoxycarbonylamino)-3-[4-[3-[[oxo-(3-pyridinylamino)methyl]amino]phenyl]phenyl]propanoic acid IUPAC Name: 2-(ethoxycarbonylamino)-3-[4-[3-(pyridin-3-ylcarbamoylamino)phenyl]phenyl]propanoic acid Traditional Name: 2-(carbethoxyamino)-3-[4-[3-(3-pyridylcarbamoylamino)phenyl]phenyl]propionic acid Formula: C24H24N4O5 MolecularWeight: 448.47116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CN=CC=C3)C(=O)O

Isomeric SMILES

CCOC(=O)NC(CC1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C24H24N4O5/c1-2-33-24(32)28-21(22(29)30)13-16-8-10-17(11-9-16)18-5-3-6-19(14-18)26-23(31)27-20-7-4-12-25-15-20/h3-12,14-15,21H,2,13H2,1H3,(H,28,32)(H,29,30)(H2,26,27,31)