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

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(isopropylcarbamoyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(isopropylcarbamoyl)acetamide Formula: C17H27ClN4O2+2 MolecularWeight: 354.87488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25ClN4O2/c1-13(2)19-17(24)20-16(23)12-22-8-6-21(7-9-22)11-14-4-3-5-15(18)10-14/h3-5,10,13H,6-9,11-12H2,1-2H3,(H2,19,20,23,24)/p+2