(4Z)-5-(hydroxymethyl)-2-methyl-1-oxidanidyl-4-[(propoxyamino)methylidene]pyridin-1-ium-3-one

Systemtic Name: (4Z)-5-(hydroxymethyl)-2-methyl-1-oxidanidyl-4-[(propoxyamino)methylidene]pyridin-1-ium-3-one Openeye Name: (4Z)-5-(hydroxymethyl)-2-methyl-1-oxido-4-[(propoxyamino)methylene]pyridin-1-ium-3-one CAS Name: (4Z)-5-(hydroxymethyl)-2-methyl-1-oxido-4-[(propoxyamino)methylidene]-3-pyridin-1-iumone IUPAC Name: (4Z)-5-(hydroxymethyl)-2-methyl-1-oxido-4-[(propoxyamino)methylidene]pyridin-1-ium-3-one Traditional Name: (4Z)-2-methyl-5-methylol-1-oxido-4-[(propoxyamino)methylene]pyridin-1-ium-3-one Formula: C11H16N2O4 MolecularWeight: 240.25574

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Descriptors Computed from Structure

Canonical SMILES:

CCCONC=C1C(=C[N+](=C(C1=O)C)[O-])CO

Isomeric SMILES

CCCON/C=C\1/C(=C[N+](=C(C1=O)C)[O-])CO

InChI

InChI=1S/C11H16N2O4/c1-3-4-17-12-5-10-9(7-14)6-13(16)8(2)11(10)15/h5-6,12,14H,3-4,7H2,1-2H3/b10-5-