2-[bis[4-(quinolin-2-ylmethoxy)phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[bis[4-(quinolin-2-ylmethoxy)phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[bis[4-(2-quinolylmethoxy)phenyl]methylsulfanyl]acetic acid CAS Name: 2-[bis[4-(2-quinolinylmethoxy)phenyl]methylthio]acetic acid IUPAC Name: 2-[bis[4-(quinolin-2-ylmethoxy)phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[bis[4-(2-quinolylmethoxy)phenyl]methylthio]acetic acid Formula: C35H28N2O4S MolecularWeight: 572.67282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)C(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)C(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)SCC(=O)O

InChI

InChI=1S/C35H28N2O4S/c38-34(39)23-42-35(26-11-17-30(18-12-26)40-21-28-15-9-24-5-1-3-7-32(24)36-28)27-13-19-31(20-14-27)41-22-29-16-10-25-6-2-4-8-33(25)37-29/h1-20,35H,21-23H2,(H,38,39)