tert-butyl 4-[5-propan-2-yl-2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-propan-2-yl-2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-isopropyl-2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[5-propan-2-yl-2-(1-pyrrolidinylmethyl)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-propan-2-yl-2-(pyrrolidin-1-ylmethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[5-isopropyl-2-(pyrrolidinomethyl)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H37N3O2 MolecularWeight: 387.55878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)CN2CCCC2)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)CN2CCCC2)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H37N3O2/c1-18(2)19-8-9-20(17-24-10-6-7-11-24)21(16-19)25-12-14-26(15-13-25)22(27)28-23(3,4)5/h8-9,16,18H,6-7,10-15,17H2,1-5H3