3-phenyl-4-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromene-4,5,7-triol; yttrium

Systemtic Name: 3-phenyl-4-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromene-4,5,7-triol; yttrium Openeye Name: 3-phenyl-4-[4-[2-(1-piperidyl)ethoxy]phenyl]chromane-4,5,7-triol; yttrium CAS Name: 3-phenyl-4-[4-[2-(1-piperidinyl)ethoxy]phenyl]-3,4-dihydro-2H-1-benzopyran-4,5,7-triol; yttrium IUPAC Name: 3-phenyl-4-[4-(2-piperidin-1-ylethoxy)phenyl]-2,3-dihydrochromene-4,5,7-triol; yttrium Traditional Name: 3-phenyl-4-[4-(2-piperidinoethoxy)phenyl]chroman-4,5,7-triol; yttrium Formula: C28H31NO5Y MolecularWeight: 550.45529

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C3(C(COC4=CC(=CC(=C43)O)O)C5=CC=CC=C5)O.[Y]

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C3(C(COC4=CC(=CC(=C43)O)O)C5=CC=CC=C5)O.[Y]

InChI

InChI=1S/C28H31NO5.Y/c30-22-17-25(31)27-26(18-22)34-19-24(20-7-3-1-4-8-20)28(27,32)21-9-11-23(12-10-21)33-16-15-29-13-5-2-6-14-29;/h1,3-4,7-12,17-18,24,30-32H,2,5-6,13-16,19H2;