4-(1-azanyl-2-chloranyl-ethylidene)piperazin-4-ium-2,6-dione

Systemtic Name: 4-(1-azanyl-2-chloranyl-ethylidene)piperazin-4-ium-2,6-dione Openeye Name: 4-(1-amino-2-chloro-ethylidene)piperazin-4-ium-2,6-dione CAS Name: 4-(1-amino-2-chloroethylidene)piperazin-4-ium-2,6-dione IUPAC Name: 4-(1-amino-2-chloroethylidene)piperazin-4-ium-2,6-dione Traditional Name: 4-(1-amino-2-chloro-ethylidene)piperazin-4-ium-2,6-quinone Formula: C6H9ClN3O2+ MolecularWeight: 190.60756

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(=O)C[N+]1=C(CCl)N

Isomeric SMILES

C1C(=O)NC(=O)C[N+]1=C(CCl)N

InChI

InChI=1S/C6H8ClN3O2/c7-1-4(8)10-2-5(11)9-6(12)3-10/h8H,1-3H2,(H,9,11,12)/p+1