2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C16H25ClN3O+ MolecularWeight: 310.8422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClN3O/c1-13(2)18-16(21)12-20-9-7-19(8-10-20)11-14-3-5-15(17)6-4-14/h3-6,13H,7-12H2,1-2H3,(H,18,21)/p+1