(4-phenyl-1-phosphono-but-3-ynyl)phosphonic acid

Systemtic Name: (4-phenyl-1-phosphono-but-3-ynyl)phosphonic acid Openeye Name: (4-phenyl-1-phosphono-but-3-ynyl)phosphonic acid CAS Name: (4-phenyl-1-phosphonobut-3-ynyl)phosphonic acid IUPAC Name: (4-phenyl-1-phosphonobut-3-ynyl)phosphonic acid Traditional Name: (4-phenyl-1-phosphono-but-3-ynyl)phosphonic acid Formula: C10H12O6P2 MolecularWeight: 290.146202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C#CCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C10H12O6P2/c11-17(12,13)10(18(14,15)16)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,8H2,(H2,11,12,13)(H2,14,15,16)