sodium (1Z)-N-[(E)-2-pyridin-3-ylethenyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate

Systemtic Name: sodium (1Z)-N-[(E)-2-pyridin-3-ylethenyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate Openeye Name: sodium (1Z)-N-[(E)-2-(3-pyridyl)vinyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate CAS Name: sodium (1Z)-N-[(E)-2-(3-pyridinyl)ethenyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate IUPAC Name: sodium (1Z)-N-[(E)-2-pyridin-3-ylethenyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate Traditional Name: sodium (1Z)-N-[(E)-2-(3-pyridyl)vinyl]sulfonyl-2,4-bis(trifluoromethyl)benzenecarboximidate Formula: C16H9F6N2NaO3S MolecularWeight: 446.299449

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10F6N2O3S.Na/c17-15(18,19)11-3-4-12(13(8-11)16(20,21)22)14(25)24-28(26,27)7-5-10-2-1-6-23-9-10;/h1-9H,(H,24,25);/q;+1/p-1/b7-5+;