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

Systemtic Name: 4-[4-aminocarbonyl-2,6-bis(chloranyl)phenyl]-4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-4-ium-2-carboxamide Openeye Name: 4-(2-amino-2-oxo-ethyl)-4-(4-carbamoyl-2,6-dichloro-phenyl)piperazin-4-ium-2-carboxamide CAS Name: 4-(2-amino-2-oxoethyl)-4-(4-carbamoyl-2,6-dichlorophenyl)-2-piperazin-4-iumcarboxamide IUPAC Name: 4-(2-amino-2-oxoethyl)-4-(4-carbamoyl-2,6-dichlorophenyl)piperazin-4-ium-2-carboxamide Traditional Name: 4-(2-amino-2-keto-ethyl)-4-(4-carbamoyl-2,6-dichloro-phenyl)piperazin-4-ium-2-carboxamide Formula: C14H18Cl2N5O3+ MolecularWeight: 375.23042

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CC(N1)C(=O)N)(CC(=O)N)C2=C(C=C(C=C2Cl)C(=O)N)Cl

Isomeric SMILES

C1C[N+](CC(N1)C(=O)N)(CC(=O)N)C2=C(C=C(C=C2Cl)C(=O)N)Cl

InChI

InChI=1S/C14H17Cl2N5O3/c15-8-3-7(13(18)23)4-9(16)12(8)21(6-11(17)22)2-1-20-10(5-21)14(19)24/h3-4,10,20H,1-2,5-6H2,(H5-,17,18,19,22,23,24)/p+1