(3-bromophenyl)-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(4-tert-butylbenzyl)piperazino]methanone Formula: C22H27BrN2O MolecularWeight: 415.36658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H27BrN2O/c1-22(2,3)19-9-7-17(8-10-19)16-24-11-13-25(14-12-24)21(26)18-5-4-6-20(23)15-18/h4-10,15H,11-14,16H2,1-3H3