N-butyl-2-[4-[2-(3,4-dichlorophenyl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-(3,4-dichlorophenyl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-(3,4-dichlorophenyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(3,4-dichlorophenyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C18H26Cl2N3O2+ MolecularWeight: 387.32394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H25Cl2N3O2/c1-2-3-6-21-17(24)13-22-7-9-23(10-8-22)18(25)12-14-4-5-15(19)16(20)11-14/h4-5,11H,2-3,6-10,12-13H2,1H3,(H,21,24)/p+1