4-[(4-tert-butylphenyl)methyl]-N-[2-chloranyl-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-N-[2-chloranyl-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[(4-tert-butylphenyl)methyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[(4-tert-butylphenyl)methyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(4-tert-butylbenzyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C23H27ClF3N3O MolecularWeight: 453.92819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C23H27ClF3N3O/c1-22(2,3)17-6-4-16(5-7-17)15-29-10-12-30(13-11-29)21(31)28-20-14-18(23(25,26)27)8-9-19(20)24/h4-9,14H,10-13,15H2,1-3H3,(H,28,31)