tert-butyl 4-[[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(1S)-1-benzyl-2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(1S)-1-benzyl-2-[(4-fluorobenzyl)amino]-2-keto-ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H34FN3O4 MolecularWeight: 483.574963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C27H34FN3O4/c1-27(2,3)35-26(34)31-15-13-21(14-16-31)24(32)30-23(17-19-7-5-4-6-8-19)25(33)29-18-20-9-11-22(28)12-10-20/h4-12,21,23H,13-18H2,1-3H3,(H,29,33)(H,30,32)/t23-/m0/s1