sodium 6-[2-[5-chloranyl-2-(cyclopenten-1-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylate

Systemtic Name: sodium 6-[2-[5-chloranyl-2-(cyclopenten-1-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylate Openeye Name: sodium 6-[2-[5-chloro-2-(cyclopenten-1-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylate CAS Name: sodium 6-[2-[5-chloro-2-(1-cyclopentenylmethoxy)phenyl]phenyl]-2-pyridinecarboxylate IUPAC Name: sodium 6-[2-[5-chloro-2-(cyclopenten-1-ylmethoxy)phenyl]phenyl]pyridine-2-carboxylate Traditional Name: sodium 6-[2-[5-chloro-2-(cyclopenten-1-ylmethoxy)phenyl]phenyl]picolinate Formula: C24H19ClNNaO3 MolecularWeight: 427.85533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C1)COC2=C(C=C(C=C2)Cl)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)[O-].[Na+]

Isomeric SMILES

C1CC=C(C1)COC2=C(C=C(C=C2)Cl)C3=CC=CC=C3C4=NC(=CC=C4)C(=O)[O-].[Na+]

InChI

InChI=1S/C24H20ClNO3.Na/c25-17-12-13-23(29-15-16-6-1-2-7-16)20(14-17)18-8-3-4-9-19(18)21-10-5-11-22(26-21)24(27)28;/h3-6,8-14H,1-2,7,15H2,(H,27,28);/q;+1/p-1