tert-butyl (2S)-4-naphthalen-1-ylcarbonyl-2-[2-(pyridin-3-ylmethoxy)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl (2S)-4-naphthalen-1-ylcarbonyl-2-[2-(pyridin-3-ylmethoxy)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl (2S)-4-(naphthalene-1-carbonyl)-2-[2-(3-pyridylmethoxy)ethyl]piperazine-1-carboxylate CAS Name: (2S)-4-[1-naphthalenyl(oxo)methyl]-2-[2-(3-pyridinylmethoxy)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-4-(naphthalene-1-carbonyl)-2-[2-(pyridin-3-ylmethoxy)ethyl]piperazine-1-carboxylate Traditional Name: (2S)-4-(1-naphthoyl)-2-[2-(3-pyridylmethoxy)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1CCOCC2=CN=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C[C@@H]1CCOCC2=CN=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H33N3O4/c1-28(2,3)35-27(33)31-16-15-30(19-23(31)13-17-34-20-21-8-7-14-29-18-21)26(32)25-12-6-10-22-9-4-5-11-24(22)25/h4-12,14,18,23H,13,15-17,19-20H2,1-3H3/t23-/m0/s1