aminocarbonyl 2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-chloranyl-2-ethyl-1-phenyl-piperidine-4-carboxylate

Systemtic Name: aminocarbonyl 2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-chloranyl-2-ethyl-1-phenyl-piperidine-4-carboxylate Openeye Name: carbamoyl 2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-chloro-2-ethyl-1-phenyl-piperidine-4-carboxylate CAS Name: 2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-4-chloro-2-ethyl-1-phenyl-4-piperidinecarboxylic acid carbamoyl ester IUPAC Name: carbamoyl 2-(1,3-benzodioxol-5-ylmethylcarbamoyl)-4-chloro-2-ethyl-1-phenylpiperidine-4-carboxylate Traditional Name: 4-chloro-2-ethyl-1-phenyl-2-(piperonylcarbamoyl)isonipecotic acid carbamoyl ester Formula: C24H26ClN3O6 MolecularWeight: 487.93274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCN1C2=CC=CC=C2)(C(=O)OC(=O)N)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1(CC(CCN1C2=CC=CC=C2)(C(=O)OC(=O)N)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H26ClN3O6/c1-2-24(20(29)27-13-16-8-9-18-19(12-16)33-15-32-18)14-23(25,21(30)34-22(26)31)10-11-28(24)17-6-4-3-5-7-17/h3-9,12H,2,10-11,13-15H2,1H3,(H2,26,31)(H,27,29)