4-(2-azanyl-2-oxidanylidene-ethyl)-4-[2,6-bis(chloranyl)-4-ethanoyl-phenyl]piperazin-4-ium-2-carboxamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethyl)-4-[2,6-bis(chloranyl)-4-ethanoyl-phenyl]piperazin-4-ium-2-carboxamide Openeye Name: 4-(4-acetyl-2,6-dichloro-phenyl)-4-(2-amino-2-oxo-ethyl)piperazin-4-ium-2-carboxamide CAS Name: 4-(4-acetyl-2,6-dichlorophenyl)-4-(2-amino-2-oxoethyl)-2-piperazin-4-iumcarboxamide IUPAC Name: 4-(4-acetyl-2,6-dichlorophenyl)-4-(2-amino-2-oxoethyl)piperazin-4-ium-2-carboxamide Traditional Name: 4-(4-acetyl-2,6-dichloro-phenyl)-4-(2-amino-2-keto-ethyl)piperazin-4-ium-2-carboxamide Formula: C15H19Cl2N4O3+ MolecularWeight: 374.24236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)Cl)[N+]2(CCNC(C2)C(=O)N)CC(=O)N)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)Cl)[N+]2(CCNC(C2)C(=O)N)CC(=O)N)Cl

InChI

InChI=1S/C15H18Cl2N4O3/c1-8(22)9-4-10(16)14(11(17)5-9)21(7-13(18)23)3-2-20-12(6-21)15(19)24/h4-5,12,20H,2-3,6-7H2,1H3,(H3-,18,19,23,24)/p+1