2-[6-[4-[4-(pyridin-2-ylmethyl)phenoxy]carbonylpiperazin-1-yl]pyridin-3-yl]ethanoic acid

Systemtic Name: 2-[6-[4-[4-(pyridin-2-ylmethyl)phenoxy]carbonylpiperazin-1-yl]pyridin-3-yl]ethanoic acid Openeye Name: 2-[6-[4-[4-(2-pyridylmethyl)phenoxy]carbonylpiperazin-1-yl]-3-pyridyl]acetic acid CAS Name: 2-[6-[4-[oxo-[4-(2-pyridinylmethyl)phenoxy]methyl]-1-piperazinyl]-3-pyridinyl]acetic acid IUPAC Name: 2-[6-[4-[4-(pyridin-2-ylmethyl)phenoxy]carbonylpiperazin-1-yl]pyridin-3-yl]acetic acid Traditional Name: 2-[6-[4-[4-(2-pyridylmethyl)phenoxy]carbonylpiperazino]-3-pyridyl]acetic acid Formula: C24H24N4O4 MolecularWeight: 432.47176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)CC(=O)O)C(=O)OC3=CC=C(C=C3)CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)CC(=O)O)C(=O)OC3=CC=C(C=C3)CC4=CC=CC=N4

InChI

InChI=1S/C24H24N4O4/c29-23(30)16-19-6-9-22(26-17-19)27-11-13-28(14-12-27)24(31)32-21-7-4-18(5-8-21)15-20-3-1-2-10-25-20/h1-10,17H,11-16H2,(H,29,30)