Catalog Number:
AG00ABGZ
Chemical Name:
1-Piperidinecarboxylic acid, 4-[1-(2-phenyl-1H-benziMidazol-1-yl)-2-[4-[1-(phenylMethyl)-1H-benziMidazol-2-yl]phenoxy]ethyl]-, 1,1-diMethylethyl ester
CAS Number:
1440754-07-3
Molecular Formula:
C45H45N5O3
Molecular Weight:
703.8705
MDL Number:
MFCD28347642
IUPAC Name:
tert-butyl 4-[2-[4-(1-benzylbenzimidazol-2-yl)phenoxy]-1-(2-phenylbenzimidazol-1-yl)ethyl]piperidine-1-carboxylate
InChI:
InChI=1S/C45H45N5O3/c1-45(2,3)53-44(51)48-28-26-33(27-29-48)41(50-40-21-13-11-19-38(40)47-43(50)34-16-8-5-9-17-34)31-52-36-24-22-35(23-25-36)42-46-37-18-10-12-20-39(37)49(42)30-32-14-6-4-7-15-32/h4-25,33,41H,26-31H2,1-3H3
InChI Key:
ZYHLHQNDSDWXSD-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)C(n1c(nc2c1cccc2)c1ccccc1)COc1ccc(cc1)c1nc2c(n1Cc1ccccc1)cccc2)OC(C)(C)C
