[(Z)-1-pyridin-4-ylpropylideneamino] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-1-pyridin-4-ylpropylideneamino] 4-methylbenzenesulfonate Openeye Name: [(Z)-1-(4-pyridyl)propylideneamino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-1-pyridin-4-ylpropylideneamino] ester IUPAC Name: [(Z)-1-pyridin-4-ylpropylideneamino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-1-(4-pyridyl)propylideneamino] ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=NC=C2

Isomeric SMILES

CC/C(=N/OS(=O)(=O)C1=CC=C(C=C1)C)/C2=CC=NC=C2

InChI

InChI=1S/C15H16N2O3S/c1-3-15(13-8-10-16-11-9-13)17-20-21(18,19)14-6-4-12(2)5-7-14/h4-11H,3H2,1-2H3/b17-15-