[4-[[3-(4-hydroxyphenyl)-7-oxidanyl-4-phenyl-2H-chromen-6-yl]amino]-4-oxidanylidene-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-[[3-(4-hydroxyphenyl)-7-oxidanyl-4-phenyl-2H-chromen-6-yl]amino]-4-oxidanylidene-1-phosphono-butyl]phosphonic acid Openeye Name: [4-[[7-hydroxy-3-(4-hydroxyphenyl)-4-phenyl-2H-chromen-6-yl]amino]-4-oxo-1-phosphono-butyl]phosphonic acid CAS Name: [4-[[7-hydroxy-3-(4-hydroxyphenyl)-4-phenyl-2H-1-benzopyran-6-yl]amino]-4-oxo-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-[[7-hydroxy-3-(4-hydroxyphenyl)-4-phenyl-2H-chromen-6-yl]amino]-4-oxo-1-phosphonobutyl]phosphonic acid Traditional Name: [4-[[7-hydroxy-3-(4-hydroxyphenyl)-4-phenyl-2H-chromen-6-yl]amino]-4-keto-1-phosphono-butyl]phosphonic acid Formula: C25H25NO10P2 MolecularWeight: 561.414222

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C2=CC(=C(C=C2O1)O)NC(=O)CCC(P(=O)(O)O)P(=O)(O)O)C3=CC=CC=C3)C4=CC=C(C=C4)O

Isomeric SMILES

C1C(=C(C2=CC(=C(C=C2O1)O)NC(=O)CCC(P(=O)(O)O)P(=O)(O)O)C3=CC=CC=C3)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H25NO10P2/c27-17-8-6-15(7-9-17)19-14-36-22-13-21(28)20(12-18(22)25(19)16-4-2-1-3-5-16)26-23(29)10-11-24(37(30,31)32)38(33,34)35/h1-9,12-13,24,27-28H,10-11,14H2,(H,26,29)(H2,30,31,32)(H2,33,34,35)