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

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(1-cyanocyclopentyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(1-cyanocyclopentyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(1-cyanocyclopentyl)acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(1-cyanocyclopentyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(1-cyanocyclopentyl)acetamide Formula: C19H27ClN4O+2 MolecularWeight: 362.89688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H25ClN4O/c20-17-5-3-4-16(12-17)13-23-8-10-24(11-9-23)14-18(25)22-19(15-21)6-1-2-7-19/h3-5,12H,1-2,6-11,13-14H2,(H,22,25)/p+2