[3,4-diethyl-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyridin-1-yl)chromen-6-yl]phosphonic acid

Systemtic Name: [3,4-diethyl-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyridin-1-yl)chromen-6-yl]phosphonic acid Openeye Name: [3,4-diethyl-3-hydroxy-2,2-dimethyl-4-(2-oxo-1-pyridyl)chroman-6-yl]phosphonic acid CAS Name: [3,4-diethyl-3-hydroxy-2,2-dimethyl-4-(2-oxo-1-pyridinyl)-3,4-dihydro-2H-1-benzopyran-6-yl]phosphonic acid IUPAC Name: [3,4-diethyl-3-hydroxy-2,2-dimethyl-4-(2-oxopyridin-1-yl)chromen-6-yl]phosphonic acid Traditional Name: [3,4-diethyl-3-hydroxy-4-(2-keto-1-pyridyl)-2,2-dimethyl-chroman-6-yl]phosphonic acid Formula: C20H26NO6P MolecularWeight: 407.397301

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C=CC(=C2)P(=O)(O)O)OC(C1(CC)O)(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCC1(C2=C(C=CC(=C2)P(=O)(O)O)OC(C1(CC)O)(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C20H26NO6P/c1-5-19(21-12-8-7-9-17(21)22)15-13-14(28(24,25)26)10-11-16(15)27-18(3,4)20(19,23)6-2/h7-13,23H,5-6H2,1-4H3,(H2,24,25,26)