2-[4-[(2-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-[(Z)-1-phenylethylideneamino]ethanamide

Systemtic Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-[(Z)-1-phenylethylideneamino]ethanamide Openeye Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-[(Z)-1-phenylethylideneamino]acetamide CAS Name: 2-[4-[(2-chlorophenyl)methyl]-1-piperazin-1-iumyl]-N-[(Z)-1-phenylethylideneamino]acetamide IUPAC Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-ium-1-yl]-N-[(Z)-1-phenylethylideneamino]acetamide Traditional Name: 2-[4-(2-chlorobenzyl)piperazin-1-ium-1-yl]-N-[(Z)-1-phenylethylideneamino]acetamide Formula: C21H26ClN4O+ MolecularWeight: 385.91034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

C/C(=N/NC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2Cl)/C3=CC=CC=C3

InChI

InChI=1S/C21H25ClN4O/c1-17(18-7-3-2-4-8-18)23-24-21(27)16-26-13-11-25(12-14-26)15-19-9-5-6-10-20(19)22/h2-10H,11-16H2,1H3,(H,24,27)/p+1/b23-17-