(phenylmethyl) (3S,4S)-3-(2-phenyl-1H-indol-3-yl)-4-[(phenylmethyl)amino]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (3S,4S)-3-(2-phenyl-1H-indol-3-yl)-4-[(phenylmethyl)amino]piperidine-1-carboxylate Openeye Name: benzyl (3S,4S)-4-(benzylamino)-3-(2-phenyl-1H-indol-3-yl)piperidine-1-carboxylate CAS Name: (3S,4S)-3-(2-phenyl-1H-indol-3-yl)-4-[(phenylmethyl)amino]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3S,4S)-4-(benzylamino)-3-(2-phenyl-1H-indol-3-yl)piperidine-1-carboxylate Traditional Name: (3S,4S)-4-(benzylamino)-3-(2-phenyl-1H-indol-3-yl)piperidine-1-carboxylic acid benzyl ester Formula: C34H33N3O2 MolecularWeight: 515.64472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1NCC2=CC=CC=C2)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CN(C[C@@H]([C@H]1NCC2=CC=CC=C2)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C34H33N3O2/c38-34(39-24-26-14-6-2-7-15-26)37-21-20-30(35-22-25-12-4-1-5-13-25)29(23-37)32-28-18-10-11-19-31(28)36-33(32)27-16-8-3-9-17-27/h1-19,29-30,35-36H,20-24H2/t29-,30-/m0/s1