(4E)-4-(2-azanyl-4H-1,3,4-thiadiazin-5-ylidene)-2-nitro-6-oxidanyl-cyclohexa-2,5-dien-1-one hydrobromide

Systemtic Name: (4E)-4-(2-azanyl-4H-1,3,4-thiadiazin-5-ylidene)-2-nitro-6-oxidanyl-cyclohexa-2,5-dien-1-one hydrobromide Openeye Name: (4E)-4-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)-2-hydroxy-6-nitro-cyclohexa-2,5-dien-1-one hydrobromide CAS Name: (4E)-4-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)-2-hydroxy-6-nitro-1-cyclohexa-2,5-dienone hydrobromide IUPAC Name: (4E)-4-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)-2-hydroxy-6-nitrocyclohexa-2,5-dien-1-one hydrobromide Traditional Name: (4E)-4-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)-2-hydroxy-6-nitro-cyclohexa-2,5-dien-1-one hydrobromide Formula: C9H9BrN4O4S MolecularWeight: 349.16116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C2C=C(C(=O)C(=C2)O)[N+](=O)[O-])NN=C(S1)N.Br

Isomeric SMILES

C1/C(=C\2/C=C(C(=O)C(=C2)O)[N+](=O)[O-])/NN=C(S1)N.Br

InChI

InChI=1S/C9H8N4O4S.BrH/c10-9-12-11-5(3-18-9)4-1-6(13(16)17)8(15)7(14)2-4;/h1-2,11,14H,3H2,(H2,10,12);1H/b5-4+;