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1-[[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methylamino]ethylphosphonic acid

1-[[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methylamino]ethylphosphonic acid

Systemtic Name:1-[[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methylamino]ethylphosphonic acid
Openeye Name:1-[[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridylidene]methylamino]ethylphosphonic acid
CAS Name:1-[[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridinylidene]methylamino]ethylphosphonic acid
IUPAC Name:1-[[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methylamino]ethylphosphonic acid
Traditional Name:1-[[3-keto-2-methyl-5-(phosphonooxymethyl)-4-pyridylidene]methylamino]ethylphosphonic acid
Formula: C10H16N2O8P2
MolecularWeight: 354.190162
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC(C)P(=O)(O)O)C1=O)COP(=O)(O)O


Isomeric SMILES

CC1=NC=C(C(=CNC(C)P(=O)(O)O)C1=O)COP(=O)(O)O


InChI

InChI=1S/C10H16N2O8P2/c1-6-10(13)9(4-12-7(2)21(14,15)16)8(3-11-6)5-20-22(17,18)19/h3-4,7,12H,5H2,1-2H3,(H2,14,15,16)(H2,17,18,19)


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