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

Systemtic Name: tert-butyl (2S)-2-(2-hydroxyethyl)-2-naphthalen-1-ylcarbonyl-piperazine-1-carboxylate Openeye Name: tert-butyl (2S)-2-(2-hydroxyethyl)-2-(naphthalene-1-carbonyl)piperazine-1-carboxylate CAS Name: (2S)-2-(2-hydroxyethyl)-2-[1-naphthalenyl(oxo)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(2-hydroxyethyl)-2-(naphthalene-1-carbonyl)piperazine-1-carboxylate Traditional Name: (2S)-2-(2-hydroxyethyl)-2-(1-naphthoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCNCC1(CCO)C(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)N1CCNC[C@@]1(CCO)C(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H28N2O4/c1-21(2,3)28-20(27)24-13-12-23-15-22(24,11-14-25)19(26)18-10-6-8-16-7-4-5-9-17(16)18/h4-10,23,25H,11-15H2,1-3H3/t22-/m0/s1