PFAS
Global PFAS Screening Tool
No. of Substances: 18960
Scopadonnine
CAS Number: 545-85-7
IUPAC name: bis(9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) (1S)-4-phenyl-2,3-dihydro-1H-naphthalene-1,4-dicarboxylate
Molecular formula: C34H38N2O6
Molecular weight: 570.7
InChI: InChI=1S/C34H38N2O6/c1-35-24-14-19(15-25(35)29-28(24)41-29)39-32(37)22-12-13-34(18-8-4-3-5-9-18,23-11-7-6-10-21(22)23)33(38)40-20-16-26-30-31(42-30)27(17-20)36(26)2/h3-11,19-20,22,24-31H,12-17H2,1-2H3/t19?,20?,22-,24?,25?,26?,27?,28?,29?,30?,31?,34?/m0/s1
InChIKey: DZKBRKKSFHBYIN-NXQBWTBDSA-N
SMILES: CN1C2CC(CC1C3C2O3)OC(=O)[C@H]4CCC(C5=CC=CC=C45)(C6=CC=CC=C6)C(=O)OC7CC8C9C(O9)C(C7)N8C
EINECS: -
