Substance
  • Substance Name: Diphenoxylate
  • Formula: C30H32N2O2
  • Molecular Weight: 452.6 g/mol
  • Identifiers:
    • casrn: 915-30-0
    • pubchemId: 13505
    • iupacname: ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate
    • inchi: InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3
    • inchikey: HYPPXZBJBPSRLK-UHFFFAOYSA-N
    • csmiles: CCOC(=O)C1(CCN(CC1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
    • ismiles: CCOC(=O)C1(CCN(CC1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
    • wikidataId: Q416431
    • chemspiderId: 12919
    • dsstoxcmpId: DTXCID902951
    • chemblId: CHEMBL1201294
    • ecnumber: 213-020-1
Diphenoxylate
Systems and Datasets