copper; 2-[[(Z)-[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]propanoic acid; hydrate

Systemtic Name: copper; 2-[[(Z)-[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]propanoic acid; hydrate Openeye Name: copper; 2-[[(Z)-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridylidene]methyl]amino]propanoic acid; hydrate CAS Name: copper; 2-[[(Z)-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridinylidene]methyl]amino]propanoic acid; hydrate IUPAC Name: copper; 2-[[(Z)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]propanoic acid; hydrate Traditional Name: copper; 2-[[(Z)-[3-keto-2-methyl-5-(phosphonooxymethyl)-4-pyridylidene]methyl]amino]propionic acid; hydrate Formula: C11H17CuN2O8P MolecularWeight: 399.781041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC(C)C(=O)O)C1=O)COP(=O)(O)O.O.[Cu]

Isomeric SMILES

CC1=NC=C(/C(=C/NC(C)C(=O)O)/C1=O)COP(=O)(O)O.O.[Cu]

InChI

InChI=1S/C11H15N2O7P.Cu.H2O/c1-6-10(14)9(4-13-7(2)11(15)16)8(3-12-6)5-20-21(17,18)19;;/h3-4,7,13H,5H2,1-2H3,(H,15,16)(H2,17,18,19);;1H2/b9-4-;;