이름: product
IUPAC: [6-[4-(2-piperidin-1-ylethoxy)phenyl]-9-(trifluoromethylsulfonyloxy)-6H-[1]benzothiolo[3,2-c]chromen-3-yl] trifluoromethanesulfonate
SMILES:
O=S(=O)(Oc1ccc2c(c1)OC(c1ccc(OCCN3CCCCC3)cc1)c1c-2sc2cc(OS(=O)(=O)C(F)(F)F)ccc12)C(F)(F)FCanonical SMILES:
C1CCN(CC1)CCOC2=CC=C(C=C2)C3C4=C(C5=C(O3)C=C(C=C5)OS(=O)(=O)C(F)(F)F)SC6=C4C=CC(=C6)OS(=O)(=O)C(F)(F)F분자식: C30H25F6NO8S3
분자량: 737.70
InChIKey: MXXMEMOOCHWSPD-UHFFFAOYSA-N
InChI:
PubChem CID: 15871363 →InChI=1S/C30H25F6NO8S3/c31-29(32,33)47(38,39)44-20-8-10-22-24(16-20)43-27(18-4-6-19(7-5-18)42-15-14-37-12-2-1-3-13-37)26-23-11-9-21(17-25(23)46-28(22)26)45-48(40,41)30(34,35)36/h4-11,16-17,27H,1-3,12-15H2동의어
3,9-Bis(trifluoromethanesulfonyloxy)-6-[4-[2-(1-piperidinyl)ethoxy]phenyl]-6-H-[1]benzothieno[3,2-c][1]benzopyran