tert-butyl 4-[2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-(1-pyrrolidinylmethyl)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-(pyrrolidinomethyl)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H31N3O2 MolecularWeight: 345.47904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C20H31N3O2/c1-20(2,3)25-19(24)23-14-12-22(13-15-23)18-9-5-4-8-17(18)16-21-10-6-7-11-21/h4-5,8-9H,6-7,10-16H2,1-3H3