3-butoxy-4-phenylmethoxy-7-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-chromen-2-one

Systemtic Name: 3-butoxy-4-phenylmethoxy-7-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-chromen-2-one Openeye Name: 4-benzyloxy-3-butoxy-7-[3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one CAS Name: 3-butoxy-4-phenylmethoxy-7-[[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]oxy]-1-benzopyran-2-one IUPAC Name: 3-butoxy-4-phenylmethoxy-7-[3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxychromen-2-one Traditional Name: 4-benzoxy-3-butoxy-7-[3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]oxy-coumarin Formula: C54H54O10 MolecularWeight: 863.00056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=C(C=C2)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OC1=O)OCC8=CC=CC=C8

Isomeric SMILES

CCCCOC1=C(C2=C(C=C(C=C2)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OC1=O)OCC8=CC=CC=C8

InChI

InChI=1S/C54H54O10/c1-2-3-31-57-51-48(58-34-40-21-11-5-12-22-40)45-30-29-44(32-46(45)63-53(51)55)62-54-52(61-37-43-27-17-8-18-28-43)50(60-36-42-25-15-7-16-26-42)49(59-35-41-23-13-6-14-24-41)47(64-54)38-56-33-39-19-9-4-10-20-39/h4-30,32,47,49-50,52,54H,2-3,31,33-38H2,1H3