CC(C)(C)OC(=O)N1Cc2cc(OS(=O)(=O)C(F)(F)F)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21

이름: Compound D

IUPAC: tert-butyl (3S)-3-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]-7-(trifluoromethylsulfonyloxy)-3,4-dihydro-1H-isoquinoline-2-carboxylate

SMILES: CC(C)(C)OC(=O)N1Cc2cc(OS(=O)(=O)C(F)(F)F)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21

Canonical SMILES: CC(C)(C)OC(=O)N1CC2=C(CC1C(=O)NC3CCCC4=CC=CC=C34)C=CC(=C2)OS(=O)(=O)C(F)(F)F

분자식: C26H29F3N2O6S

분자량: 554.60

InChIKey: USQIWLRAYVUDOO-YADHBBJMSA-N

InChI:

InChI=1S/C26H29F3N2O6S/c1-25(2,3)36-24(33)31-15-18-13-19(37-38(34,35)26(27,28)29)12-11-17(18)14-22(31)23(32)30-21-10-6-8-16-7-4-5-9-20(16)21/h4-5,7,9,11-13,21-22H,6,8,10,14-15H2,1-3H3,(H,30,32)/t21-,22+/m1/s1

PubChem CID: 86705865 →

동의어

(S)-tert-butyl 3-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)-7-(((trifluoromethyl)sulfonyl)oxy)-3,4-dihydroisoquinoline-2(1H)-carboxylateSCHEMBL15630538

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