tert-butyl 4-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-chlorophenyl)-2-hydroxy-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-chlorophenyl)-2-hydroxyethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-chlorophenyl)-2-hydroxyethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-chlorophenyl)-2-hydroxy-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H25ClN2O3 MolecularWeight: 340.845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(C2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(C2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C17H25ClN2O3/c1-17(2,3)23-16(22)20-10-8-19(9-11-20)12-15(21)13-4-6-14(18)7-5-13/h4-7,15,21H,8-12H2,1-3H3