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

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(4-methylcyclohexyl)ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(4-methylcyclohexyl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(4-methylcyclohexyl)acetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(4-methylcyclohexyl)acetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(4-methylcyclohexyl)acetamide Formula: C20H32ClN3O+2 MolecularWeight: 365.94058

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCC(CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H30ClN3O/c1-16-2-8-19(9-3-16)22-20(25)15-24-12-10-23(11-13-24)14-17-4-6-18(21)7-5-17/h4-7,16,19H,2-3,8-15H2,1H3,(H,22,25)/p+2