[[(5-butyl-1,2-oxazol-3-yl)amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[(5-butyl-1,2-oxazol-3-yl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [[(5-butylisoxazol-3-yl)amino]-phosphono-methyl]phosphonic acid CAS Name: [[(5-butyl-3-isoxazolyl)amino]-phosphonomethyl]phosphonic acid IUPAC Name: [[(5-butyl-1,2-oxazol-3-yl)amino]-phosphonomethyl]phosphonic acid Traditional Name: [[(5-butylisoxazol-3-yl)amino]-phosphono-methyl]phosphonic acid Formula: C8H16N2O7P2 MolecularWeight: 314.169362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=NO1)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCC1=CC(=NO1)NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H16N2O7P2/c1-2-3-4-6-5-7(10-17-6)9-8(18(11,12)13)19(14,15)16/h5,8H,2-4H2,1H3,(H,9,10)(H2,11,12,13)(H2,14,15,16)