4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butyl-piperazine-1-carboxamide

Systemtic Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butyl-piperazine-1-carboxamide Openeye Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butyl-piperazine-1-carboxamide CAS Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butyl-1-piperazinecarboxamide IUPAC Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butylpiperazine-1-carboxamide Traditional Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-tert-butyl-piperazine-1-carboxamide Formula: C22H27BrClN3O MolecularWeight: 464.82628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCN(CC1)C(C2=CC=C(C=C2)Br)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)NC(=O)N1CCN(CC1)C(C2=CC=C(C=C2)Br)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H27BrClN3O/c1-22(2,3)25-21(28)27-14-12-26(13-15-27)20(16-8-10-17(23)11-9-16)18-6-4-5-7-19(18)24/h4-11,20H,12-15H2,1-3H3,(H,25,28)