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

Systemtic Name: sodium (1Z)-2,4-dimethyl-N-[(E)-2-pyridin-4-ylethenyl]sulfonyl-benzenecarboximidate Openeye Name: sodium (1Z)-2,4-dimethyl-N-[(E)-2-(4-pyridyl)vinyl]sulfonyl-benzenecarboximidate CAS Name: sodium (1Z)-2,4-dimethyl-N-[(E)-2-pyridin-4-ylethenyl]sulfonylbenzenecarboximidate IUPAC Name: sodium (1Z)-2,4-dimethyl-N-[(E)-2-pyridin-4-ylethenyl]sulfonylbenzenecarboximidate Traditional Name: sodium (1Z)-2,4-dimethyl-N-[(E)-2-(4-pyridyl)vinyl]sulfonyl-benzenecarboximidate Formula: C16H15N2NaO3S MolecularWeight: 338.35667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=NS(=O)(=O)C=CC2=CC=NC=C2)[O-])C.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1)/C(=N/S(=O)(=O)/C=C/C2=CC=NC=C2)/[O-])C.[Na+]

InChI

InChI=1S/C16H16N2O3S.Na/c1-12-3-4-15(13(2)11-12)16(19)18-22(20,21)10-7-14-5-8-17-9-6-14;/h3-11H,1-2H3,(H,18,19);/q;+1/p-1/b10-7+;