N-(tert-butylcarbamoyl)-2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(tert-butylcarbamoyl)-2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C18H29ClN4O2+2 MolecularWeight: 368.90146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H27ClN4O2/c1-18(2,3)21-17(25)20-16(24)13-23-10-8-22(9-11-23)12-14-4-6-15(19)7-5-14/h4-7H,8-13H2,1-3H3,(H2,20,21,24,25)/p+2