tert-butyl 4-[(3-cyanophenyl)methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-cyanophenyl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(3-cyanophenyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(3-cyanophenyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-cyanophenyl)methyl]piperazine-1-carboxylate Traditional Name: 4-(3-cyanobenzyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H23N3O2/c1-17(2,3)22-16(21)20-9-7-19(8-10-20)13-15-6-4-5-14(11-15)12-18/h4-6,11H,7-10,13H2,1-3H3