2-[[(E)-azanyl-[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-azanyl-[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]ethanoic acid Openeye Name: 2-[[(E)-amino-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridylidene]methyl]amino]acetic acid CAS Name: 2-[[(E)-amino-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridinylidene]methyl]amino]acetic acid IUPAC Name: 2-[[(E)-amino-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino]acetic acid Traditional Name: 2-[[(E)-amino-[3-keto-2-methyl-5-(phosphonooxymethyl)-4-pyridylidene]methyl]amino]acetic acid Formula: C10H14N3O7P MolecularWeight: 319.207821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C(N)NCC(=O)O)C1=O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(/C(=C(/N)\NCC(=O)O)/C1=O)COP(=O)(O)O

InChI

InChI=1S/C10H14N3O7P/c1-5-9(16)8(10(11)13-3-7(14)15)6(2-12-5)4-20-21(17,18)19/h2,13H,3-4,11H2,1H3,(H,14,15)(H2,17,18,19)/b10-8+