tert-butyl 4-[(1S)-2-azanyl-1-(3-bromophenyl)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1S)-2-azanyl-1-(3-bromophenyl)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(1S)-2-amino-1-(3-bromophenyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[(1S)-2-amino-1-(3-bromophenyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1S)-2-amino-1-(3-bromophenyl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[(1S)-2-amino-1-(3-bromophenyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H26BrN3O2 MolecularWeight: 384.31124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(CN)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)[C@H](CN)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H26BrN3O2/c1-17(2,3)23-16(22)21-9-7-20(8-10-21)15(12-19)13-5-4-6-14(18)11-13/h4-6,11,15H,7-10,12,19H2,1-3H3/t15-/m1/s1