4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[(2,2,2-trichloroacetyl)amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Molecular Formula: C27H24Cl3NO6S


InChI: InChI=1/C27H24Cl3NO6S/c28-27(29,30)26(35)31-20-3-1-2-19(12-20)25-36-21(15-38-22-10-8-18(9-11-22)24(33)34)13-23(37-25)17-6-4-16(14-32)5-7-17/h1-12,21,23,25,32H,13-15H2,(H,31,35)(H,33,34)/f/h31,33H

InChIKey: InChIKey=CXARGRZJEDMXPW-PINXXQJSCM
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC(=CC=C3)NC(=O)C(Cl)(Cl)Cl)CSC4=CC=C(C=C4)C(=O)O

Names:
    4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[(2,2,2-trichloroacetyl)amino]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Registries:
    PubChem CID 4088965
    PubChem ID 6007349