[1-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]cycloprop-2-en-1-yl]phosphonic acid

Systemtic Name: [1-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]cycloprop-2-en-1-yl]phosphonic acid Openeye Name: [1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]cycloprop-2-en-1-yl]phosphonic acid CAS Name: [1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]-1-cycloprop-2-enyl]phosphonic acid IUPAC Name: [1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]cycloprop-2-en-1-yl]phosphonic acid Traditional Name: [1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]cycloprop-2-en-1-yl]phosphonic acid Formula: C11H16N2O8P2 MolecularWeight: 366.200862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNC2(C=C2)P(=O)(O)O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CNC2(C=C2)P(=O)(O)O)COP(=O)(O)O

InChI

InChI=1S/C11H16N2O8P2/c1-7-10(14)9(5-13-11(2-3-11)22(15,16)17)8(4-12-7)6-21-23(18,19)20/h2-4,13-14H,5-6H2,1H3,(H2,15,16,17)(H2,18,19,20)