5-[2-(4-chloranyl-2-nitro-phenyl)hydrazinyl]-3,3-bis(hydroxymethyl)-2H-1,4-oxazin-4-ium-6-one

Systemtic Name: 5-[2-(4-chloranyl-2-nitro-phenyl)hydrazinyl]-3,3-bis(hydroxymethyl)-2H-1,4-oxazin-4-ium-6-one Openeye Name: 5-[2-(4-chloro-2-nitro-phenyl)hydrazino]-3,3-bis(hydroxymethyl)-2H-1,4-oxazin-4-ium-6-one CAS Name: 5-[(4-chloro-2-nitrophenyl)hydrazo]-3,3-bis(hydroxymethyl)-2H-1,4-oxazin-4-ium-6-one IUPAC Name: 5-[2-(4-chloro-2-nitrophenyl)hydrazinyl]-3,3-bis(hydroxymethyl)-2H-1,4-oxazin-4-ium-6-one Traditional Name: 5-[N'-(4-chloro-2-nitro-phenyl)hydrazino]-3,3-dimethylol-2H-1,4-oxazin-4-ium-6-one Formula: C12H14ClN4O6+ MolecularWeight: 345.71576

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH+]=C(C(=O)O1)NNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])(CO)CO

Isomeric SMILES

C1C([NH+]=C(C(=O)O1)NNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])(CO)CO

InChI

InChI=1S/C12H13ClN4O6/c13-7-1-2-8(9(3-7)17(21)22)15-16-10-11(20)23-6-12(4-18,5-19)14-10/h1-3,15,18-19H,4-6H2,(H,14,16)/p+1