4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl chloride

Systemtic Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl chloride Openeye Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl chloride CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)methyl]benzoyl chloride IUPAC Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl chloride Traditional Name: 4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzoyl chloride Formula: C13H18ClN2O+ MolecularWeight: 253.74782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClN2O/c1-15-6-8-16(9-7-15)10-11-2-4-12(5-3-11)13(14)17/h2-5H,6-10H2,1H3/p+1