tert-butyl 4-[phenyl-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[phenyl-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-(4-benzyl-1-piperidyl)propyl-phenyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-benzylpiperidin-1-yl)propyl-phenylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[3-(4-benzylpiperidino)propyl-phenyl-carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H45N3O3 MolecularWeight: 519.718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H45N3O3/c1-32(2,3)38-31(37)34-23-17-28(18-24-34)30(36)35(29-13-8-5-9-14-29)20-10-19-33-21-15-27(16-22-33)25-26-11-6-4-7-12-26/h4-9,11-14,27-28H,10,15-25H2,1-3H3