N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-(3-chloro-2-methylphenyl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C20H23ClN3O2+ MolecularWeight: 372.86852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O2/c1-15-17(21)8-5-9-18(15)22-19(25)14-23-10-12-24(13-11-23)20(26)16-6-3-2-4-7-16/h2-9H,10-14H2,1H3,(H,22,25)/p+1