N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetamide Formula: C19H20Cl2N3O3+ MolecularWeight: 409.2864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC3=C(C=C2Cl)OCO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC3=C(C=C2Cl)OCO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H19Cl2N3O3/c20-13-2-1-3-14(8-13)24-6-4-23(5-7-24)11-19(25)22-16-10-18-17(9-15(16)21)26-12-27-18/h1-3,8-10H,4-7,11-12H2,(H,22,25)/p+1