sodium (1Z)-2-bromanyl-4-fluoranyl-N-[(E)-2-pyridin-2-ylethenyl]sulfonyl-benzenecarboximidate

Systemtic Name: sodium (1Z)-2-bromanyl-4-fluoranyl-N-[(E)-2-pyridin-2-ylethenyl]sulfonyl-benzenecarboximidate Openeye Name: sodium (1Z)-2-bromo-4-fluoro-N-[(E)-2-(2-pyridyl)vinyl]sulfonyl-benzenecarboximidate CAS Name: sodium (1Z)-2-bromo-4-fluoro-N-[(E)-2-(2-pyridinyl)ethenyl]sulfonylbenzenecarboximidate IUPAC Name: sodium (1Z)-2-bromo-4-fluoro-N-[(E)-2-pyridin-2-ylethenyl]sulfonylbenzenecarboximidate Traditional Name: sodium (1Z)-2-bromo-4-fluoro-N-[(E)-2-(2-pyridyl)vinyl]sulfonyl-benzenecarboximidate Formula: C14H9BrFN2NaO3S MolecularWeight: 407.190033

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=CS(=O)(=O)N=C(C2=C(C=C(C=C2)F)Br)[O-].[Na+]

Isomeric SMILES

C1=CC=NC(=C1)/C=C/S(=O)(=O)/N=C(/C2=C(C=C(C=C2)F)Br)\[O-].[Na+]

InChI

InChI=1S/C14H10BrFN2O3S.Na/c15-13-9-10(16)4-5-12(13)14(19)18-22(20,21)8-6-11-3-1-2-7-17-11;/h1-9H,(H,18,19);/q;+1/p-1/b8-6+;