tert-butyl [2-methyl-3-[6-(2-oxidanylidenepiperidin-1-yl)-2-propyl-benzimidazol-1-yl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-methyl-3-[6-(2-oxidanylidenepiperidin-1-yl)-2-propyl-benzimidazol-1-yl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-methyl-3-[6-(2-oxo-1-piperidyl)-2-propyl-benzimidazol-1-yl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-methyl-3-[6-(2-oxo-1-piperidinyl)-2-propyl-1-benzimidazolyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-methyl-3-[6-(2-oxopiperidin-1-yl)-2-propylbenzimidazol-1-yl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[6-(2-ketopiperidino)-2-propyl-benzimidazol-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C33H37N3O4 MolecularWeight: 539.66458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)N5CCCCC5=O

Isomeric SMILES

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C=C(C=C2)N5CCCCC5=O

InChI

InChI=1S/C33H37N3O4/c1-6-12-29-34-26-18-16-24(35-20-11-10-15-30(35)37)21-28(26)36(29)27-19-17-25(23-13-8-7-9-14-23)31(22(27)2)39-32(38)40-33(3,4)5/h7-9,13-14,16-19,21H,6,10-12,15,20H2,1-5H3