2-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]ethyl hydrogen sulfate

Systemtic Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]ethyl hydrogen sulfate Openeye Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]ethyl hydrogen sulfate CAS Name: sulfuric acid 2-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]ethyl ester IUPAC Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]ethyl ester Formula: C10H14N2O6S MolecularWeight: 290.29296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNCCOS(=O)(=O)O)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNCCOS(=O)(=O)O)C1=O)CO

InChI

InChI=1S/C10H14N2O6S/c1-7-10(14)9(8(6-13)4-12-7)5-11-2-3-18-19(15,16)17/h4-5,11,13H,2-3,6H2,1H3,(H,15,16,17)