4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[3-[(prop-2-enoxycarbonylamino)methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C36H35NO7S
InChI: InChI=1/C36H35NO7S/c1-2-17-42-36(41)37-21-25-5-3-6-28(18-25)29-7-4-8-30(19-29)35-43-31(23-45-32-15-13-27(14-16-32)34(39)40)20-33(44-35)26-11-9-24(22-38)10-12-26/h2-16,18-19,31,33,35,38H,1,17,20-23H2,(H,37,41)(H,39,40)/f/h37,39H
InChIKey: InChIKey=PUPLTEUGWRWTGJ-WUPVYKDLCS
SMILES: C=CCOC(=O)NCC1=CC=CC(=C1)C2=CC(=CC=C2)C3OC(CC(O3)C4=CC=C(C=C4)CO)CSC5=CC=C(C=C5)C(=O)O
Names:
4-[[6-[4-(hydroxymethyl)phenyl]-2-[3-[3-[(prop-2-enoxycarbonylamino)methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4143631
PubChem ID 6080503
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