(4E)-4-(6-iodanyl-3H-1,3-benzothiazol-2-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(6-iodanyl-3H-1,3-benzothiazol-2-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-3-hydroxy-4-(6-iodo-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-3-hydroxy-4-(6-iodo-3H-1,3-benzothiazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-3-hydroxy-4-(6-iodo-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-3-hydroxy-4-(6-iodo-3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C13H8INO2S MolecularWeight: 369.17759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1I)SC(=C3C=CC(=O)C=C3O)N2

Isomeric SMILES

C1=CC2=C(C=C1I)S/C(=C/3\C=CC(=O)C=C3O)/N2

InChI

InChI=1S/C13H8INO2S/c14-7-1-4-10-12(5-7)18-13(15-10)9-3-2-8(16)6-11(9)17/h1-6,15,17H/b13-9+