sodium 2-[4-[(5,6-diphenylpyridin-2-yl)-methyl-amino]butoxy]ethanoate

Systemtic Name: sodium 2-[4-[(5,6-diphenylpyridin-2-yl)-methyl-amino]butoxy]ethanoate Openeye Name: sodium 2-[4-[(5,6-diphenyl-2-pyridyl)-methyl-amino]butoxy]acetate CAS Name: sodium 2-[4-[(5,6-diphenyl-2-pyridinyl)-methylamino]butoxy]acetate IUPAC Name: sodium 2-[4-[(5,6-diphenylpyridin-2-yl)-methylamino]butoxy]acetate Traditional Name: sodium 2-[4-[(5,6-diphenyl-2-pyridyl)-methyl-amino]butoxy]acetate Formula: C24H25N2NaO3 MolecularWeight: 412.45667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCOCC(=O)[O-])C1=NC(=C(C=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CN(CCCCOCC(=O)[O-])C1=NC(=C(C=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C24H26N2O3.Na/c1-26(16-8-9-17-29-18-23(27)28)22-15-14-21(19-10-4-2-5-11-19)24(25-22)20-12-6-3-7-13-20;/h2-7,10-15H,8-9,16-18H2,1H3,(H,27,28);/q;+1/p-1