4-(2-azanyl-2-oxidanylidene-ethyl)-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethyl)-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-(2-amino-2-oxo-ethyl)-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-(2-amino-2-oxoethyl)-N-(3,4-dichlorophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-(2-amino-2-oxoethyl)-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-amino-2-keto-ethyl)-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Formula: C13H17Cl2N4O2+ MolecularWeight: 332.20568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)C(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)C(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H16Cl2N4O2/c14-10-2-1-9(7-11(10)15)17-13(21)19-5-3-18(4-6-19)8-12(16)20/h1-2,7H,3-6,8H2,(H2,16,20)(H,17,21)/p+1