tert-butyl 4-[4-aminocarbonyl-3-[2-(5-cyano-2-phenylmethoxy-phenoxy)ethyl]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-aminocarbonyl-3-[2-(5-cyano-2-phenylmethoxy-phenoxy)ethyl]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[2-(2-benzyloxy-5-cyano-phenoxy)ethyl]-4-carbamoyl-phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-carbamoyl-3-[2-(5-cyano-2-phenylmethoxyphenoxy)ethyl]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-carbamoyl-3-[2-(5-cyano-2-phenylmethoxyphenoxy)ethyl]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[3-[2-(2-benzoxy-5-cyano-phenoxy)ethyl]-4-carbamoyl-phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C33H37N3O6 MolecularWeight: 571.66338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)C(=O)N)CCOC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)C(=O)N)CCOC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C33H37N3O6/c1-33(2,3)42-32(38)36-16-13-26(14-17-36)41-27-10-11-28(31(35)37)25(20-27)15-18-39-30-19-24(21-34)9-12-29(30)40-22-23-7-5-4-6-8-23/h4-12,19-20,26H,13-18,22H2,1-3H3,(H2,35,37)