tert-butyl (2S)-4-naphthalen-1-ylcarbonyl-2-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl (2S)-4-naphthalen-1-ylcarbonyl-2-(phenylmethyl)piperazine-1-carboxylate Openeye Name: tert-butyl (2S)-2-benzyl-4-(naphthalene-1-carbonyl)piperazine-1-carboxylate CAS Name: (2S)-4-[1-naphthalenyl(oxo)methyl]-2-(phenylmethyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-benzyl-4-(naphthalene-1-carbonyl)piperazine-1-carboxylate Traditional Name: (2S)-2-benzyl-4-(1-naphthoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C27H30N2O3 MolecularWeight: 430.5387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1CC2=CC=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C[C@@H]1CC2=CC=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H30N2O3/c1-27(2,3)32-26(31)29-17-16-28(19-22(29)18-20-10-5-4-6-11-20)25(30)24-15-9-13-21-12-7-8-14-23(21)24/h4-15,22H,16-19H2,1-3H3/t22-/m0/s1