[(E)-4-oxidanylidene-6-phenyl-1-phosphono-hex-5-enyl]phosphonic acid

Systemtic Name: [(E)-4-oxidanylidene-6-phenyl-1-phosphono-hex-5-enyl]phosphonic acid Openeye Name: [(E)-4-oxo-6-phenyl-1-phosphono-hex-5-enyl]phosphonic acid CAS Name: [(E)-4-oxo-6-phenyl-1-phosphonohex-5-enyl]phosphonic acid IUPAC Name: [(E)-4-oxo-6-phenyl-1-phosphonohex-5-enyl]phosphonic acid Traditional Name: [(E)-4-keto-6-phenyl-1-phosphono-hex-5-enyl]phosphonic acid Formula: C12H16O7P2 MolecularWeight: 334.198762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O7P2/c13-11(7-6-10-4-2-1-3-5-10)8-9-12(20(14,15)16)21(17,18)19/h1-7,12H,8-9H2,(H2,14,15,16)(H2,17,18,19)/b7-6+