(4Z)-3-oxidanyl-4-(2H-1,2,3,4-tetrazol-5-ylhydrazinylidene)cyclohexa-2,5-dien-1-one hydrate

Systemtic Name: (4Z)-3-oxidanyl-4-(2H-1,2,3,4-tetrazol-5-ylhydrazinylidene)cyclohexa-2,5-dien-1-one hydrate Openeye Name: (4Z)-3-hydroxy-4-(2H-tetrazol-5-ylhydrazono)cyclohexa-2,5-dien-1-one hydrate CAS Name: (4Z)-3-hydroxy-4-(2H-tetrazol-5-ylhydrazinylidene)-1-cyclohexa-2,5-dienone hydrate IUPAC Name: (4Z)-3-hydroxy-4-(2H-tetrazol-5-ylhydrazinylidene)cyclohexa-2,5-dien-1-one hydrate Traditional Name: (4Z)-3-hydroxy-4-(2H-tetrazol-5-ylhydrazono)cyclohexa-2,5-dien-1-one hydrate Formula: C7H8N6O3 MolecularWeight: 224.17682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NNC2=NNN=N2)C(=CC1=O)O.O

Isomeric SMILES

C1=C/C(=N/NC2=NNN=N2)/C(=CC1=O)O.O

InChI

InChI=1S/C7H6N6O2.H2O/c14-4-1-2-5(6(15)3-4)8-9-7-10-12-13-11-7;/h1-3,15H,(H2,9,10,11,12,13);1H2/b8-5-;