4-[4-(3-fluoranyl-2H-1,2-thiazol-5-ylidene)cyclohexa-2,5-dien-1-ylidene]-4-nitroso-butanoic acid

Systemtic Name: 4-[4-(3-fluoranyl-2H-1,2-thiazol-5-ylidene)cyclohexa-2,5-dien-1-ylidene]-4-nitroso-butanoic acid Openeye Name: 4-[4-(3-fluoro-2H-isothiazol-5-ylidene)cyclohexa-2,5-dien-1-ylidene]-4-nitroso-butanoic acid CAS Name: 4-[4-(3-fluoro-2H-isothiazol-5-ylidene)-1-cyclohexa-2,5-dienylidene]-4-nitrosobutanoic acid IUPAC Name: 4-[4-(3-fluoro-2H-1,2-thiazol-5-ylidene)cyclohexa-2,5-dien-1-ylidene]-4-nitrosobutanoic acid Traditional Name: 4-[4-(3-fluoro-3-isothiazolin-5-ylidene)cyclohexa-2,5-dien-1-ylidene]-4-nitroso-butyric acid Formula: C13H11FN2O3S MolecularWeight: 294.301443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(CCC(=O)O)N=O)C=CC1=C2C=C(NS2)F

Isomeric SMILES

C1=CC(=C(CCC(=O)O)N=O)C=CC1=C2C=C(NS2)F

InChI

InChI=1S/C13H11FN2O3S/c14-12-7-11(20-16-12)9-3-1-8(2-4-9)10(15-19)5-6-13(17)18/h1-4,7,16H,5-6H2,(H,17,18)