1-[4-[3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]ethanolate

Systemtic Name: 1-[4-[3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]ethanolate Openeye Name: 1-[4-[3-(azaniumylmethyl)-4-fluoro-phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]ethanolate CAS Name: 1-[4-[3-(ammoniomethyl)-4-fluorophenyl]sulfonylimino-1-cyclohexa-2,5-dienylidene]ethanolate IUPAC Name: 1-[4-[3-(azaniumylmethyl)-4-fluorophenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]ethanolate Traditional Name: 1-[4-[3-(ammoniomethyl)-4-fluoro-phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]ethanolate Formula: C15H15FN2O3S MolecularWeight: 322.354603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=NS(=O)(=O)C2=CC(=C(C=C2)F)C[NH3+])C=C1)[O-]

Isomeric SMILES

CC(=C1C=CC(=NS(=O)(=O)C2=CC(=C(C=C2)F)C[NH3+])C=C1)[O-]

InChI

InChI=1S/C15H15FN2O3S/c1-10(19)11-2-4-13(5-3-11)18-22(20,21)14-6-7-15(16)12(8-14)9-17/h2-8,19H,9,17H2,1H3