(4-oxidanylidene-4-phenyl-1-phosphono-3-pyridin-2-yl-butyl)phosphonic acid

Systemtic Name: (4-oxidanylidene-4-phenyl-1-phosphono-3-pyridin-2-yl-butyl)phosphonic acid Openeye Name: [4-oxo-4-phenyl-1-phosphono-3-(2-pyridyl)butyl]phosphonic acid CAS Name: [4-oxo-4-phenyl-1-phosphono-3-(2-pyridinyl)butyl]phosphonic acid IUPAC Name: (4-oxo-4-phenyl-1-phosphono-3-pyridin-2-ylbutyl)phosphonic acid Traditional Name: [4-keto-4-phenyl-1-phosphono-3-(2-pyridyl)butyl]phosphonic acid Formula: C15H17NO7P2 MolecularWeight: 385.245502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(CC(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(CC(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=N2

InChI

InChI=1S/C15H17NO7P2/c17-15(11-6-2-1-3-7-11)12(13-8-4-5-9-16-13)10-14(24(18,19)20)25(21,22)23/h1-9,12,14H,10H2,(H2,18,19,20)(H2,21,22,23)