N-(2-chloranyl-5-methyl-phenyl)-2-(4-methanoylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-2-(4-methanoylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-chloro-5-methyl-phenyl)-2-(4-formylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-chloro-5-methylphenyl)-2-(4-formyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-5-methylphenyl)-2-(4-formylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-5-methyl-phenyl)-2-(4-formylpiperazin-1-ium-1-yl)acetamide Formula: C14H19ClN3O2+ MolecularWeight: 296.77256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)C=O

InChI

InChI=1S/C14H18ClN3O2/c1-11-2-3-12(15)13(8-11)16-14(20)9-17-4-6-18(10-19)7-5-17/h2-3,8,10H,4-7,9H2,1H3,(H,16,20)/p+1