N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: N-[3-chloro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C13H19ClN3O+ MolecularWeight: 268.76246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CC[NH+](CC2)C)Cl

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C13H18ClN3O/c1-10(18)15-11-3-4-13(12(14)9-11)17-7-5-16(2)6-8-17/h3-4,9H,5-8H2,1-2H3,(H,15,18)/p+1