2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-p-anisyl-acetamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O3/c1-28-17-8-6-16(7-9-17)14-23-20(26)15-24-10-12-25(13-11-24)21(27)18-4-2-3-5-19(18)22/h2-9H,10-15H2,1H3,(H,23,26)/p+1