tert-butyl 2-(4-cyanophenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-(4-cyanophenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 2-(4-cyanophenyl)piperazine-1-carboxylate CAS Name: 2-(4-cyanophenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-cyanophenyl)piperazine-1-carboxylate Traditional Name: 2-(4-cyanophenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCNCC1C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCNCC1C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H21N3O2/c1-16(2,3)21-15(20)19-9-8-18-11-14(19)13-6-4-12(10-17)5-7-13/h4-7,14,18H,8-9,11H2,1-3H3