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

Systemtic Name: [[[5-[(E)-2-phenylethenyl]-1,2-oxazol-3-yl]amino]-phosphono-methyl]phosphonic acid Openeye Name: [phosphono-[[5-[(E)-styryl]isoxazol-3-yl]amino]methyl]phosphonic acid CAS Name: [[[5-[(E)-2-phenylethenyl]-3-isoxazolyl]amino]-phosphonomethyl]phosphonic acid IUPAC Name: [[[5-[(E)-2-phenylethenyl]-1,2-oxazol-3-yl]amino]-phosphonomethyl]phosphonic acid Traditional Name: [phosphono-[[5-[(E)-styryl]isoxazol-3-yl]amino]methyl]phosphonic acid Formula: C12H14N2O7P2 MolecularWeight: 360.196282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=CC(=NO2)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=CC(=NO2)NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C12H14N2O7P2/c15-22(16,17)12(23(18,19)20)13-11-8-10(21-14-11)7-6-9-4-2-1-3-5-9/h1-8,12H,(H,13,14)(H2,15,16,17)(H2,18,19,20)/b7-6+