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

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-N-(2-chloranyl-4-methyl-phenyl)piperazine-1-carboxamide Openeye Name: 4-[(4-tert-butylphenyl)methyl]-N-(2-chloro-4-methyl-phenyl)piperazine-1-carboxamide CAS Name: 4-[(4-tert-butylphenyl)methyl]-N-(2-chloro-4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-N-(2-chloro-4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(4-tert-butylbenzyl)-N-(2-chloro-4-methyl-phenyl)piperazine-1-carboxamide Formula: C23H30ClN3O MolecularWeight: 399.9568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C)Cl

InChI

InChI=1S/C23H30ClN3O/c1-17-5-10-21(20(24)15-17)25-22(28)27-13-11-26(12-14-27)16-18-6-8-19(9-7-18)23(2,3)4/h5-10,15H,11-14,16H2,1-4H3,(H,25,28)