[(2S)-2-[bis(phenylmethyl)amino]propyl] 4-(2-methylbenzimidazol-1-yl)piperidine-1-carboxylate

Systemtic Name: [(2S)-2-[bis(phenylmethyl)amino]propyl] 4-(2-methylbenzimidazol-1-yl)piperidine-1-carboxylate Openeye Name: [(2S)-2-(dibenzylamino)propyl] 4-(2-methylbenzimidazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(2-methyl-1-benzimidazolyl)-1-piperidinecarboxylic acid [(2S)-2-[bis(phenylmethyl)amino]propyl] ester IUPAC Name: [(2S)-2-(dibenzylamino)propyl] 4-(2-methylbenzimidazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(2-methylbenzimidazol-1-yl)piperidine-1-carboxylic acid [(2S)-2-(dibenzylamino)propyl] ester Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1C3CCN(CC3)C(=O)OCC(C)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2N1C3CCN(CC3)C(=O)OC[C@H](C)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C31H36N4O2/c1-24(34(21-26-11-5-3-6-12-26)22-27-13-7-4-8-14-27)23-37-31(36)33-19-17-28(18-20-33)35-25(2)32-29-15-9-10-16-30(29)35/h3-16,24,28H,17-23H2,1-2H3/t24-/m0/s1