2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[(cyclohexylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Formula: C20H31ClN4O2+2 MolecularWeight: 394.93874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H29ClN4O2/c21-17-6-4-5-16(13-17)14-24-9-11-25(12-10-24)15-19(26)23-20(27)22-18-7-2-1-3-8-18/h4-6,13,18H,1-3,7-12,14-15H2,(H2,22,23,26,27)/p+2