3-[2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-[4-(2-chlorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-[4-(2-chlorophenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N-diethyl-benzamide Formula: C23H30ClN4O2+ MolecularWeight: 429.9629

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClN4O2/c1-3-27(4-2)23(30)18-8-7-9-19(16-18)25-22(29)17-26-12-14-28(15-13-26)21-11-6-5-10-20(21)24/h5-11,16H,3-4,12-15,17H2,1-2H3,(H,25,29)/p+1