[2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methyl-6-oxidanylidene-pyridin-1-yl] ethanesulfonate

Systemtic Name: [2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methyl-6-oxidanylidene-pyridin-1-yl] ethanesulfonate Openeye Name: [2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-4-methyl-6-oxo-1-pyridyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methyl-6-oxo-1-pyridinyl] ester IUPAC Name: [2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4-methyl-6-oxopyridin-1-yl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-6-keto-4-methyl-1-pyridyl] ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)ON1C(=CC(=CC1=O)C)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCS(=O)(=O)ON1C(=CC(=CC1=O)C)/C=C/C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H21NO6S/c1-5-26(21,22)25-19-15(10-13(2)11-18(19)20)8-6-14-7-9-16(23-3)17(12-14)24-4/h6-12H,5H2,1-4H3/b8-6+