(4E)-4-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-2-nitro-5-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-2-nitro-5-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[[2-(1,3-benzothiazol-2-yl)hydrazino]methylene]-5-hydroxy-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[(1,3-benzothiazol-2-ylhydrazo)methylidene]-5-hydroxy-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[[2-(1,3-benzothiazol-2-yl)hydrazinyl]methylidene]-5-hydroxy-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[[N'-(1,3-benzothiazol-2-yl)hydrazino]methylene]-5-hydroxy-2-nitro-cyclohexa-2,5-dien-1-one Formula: C14H10N4O4S MolecularWeight: 330.3186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NNC=C3C=C(C(=O)C=C3O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NN/C=C/3\C=C(C(=O)C=C3O)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O4S/c19-11-6-12(20)10(18(21)22)5-8(11)7-15-17-14-16-9-3-1-2-4-13(9)23-14/h1-7,15,19H,(H,16,17)/b8-7+