[5-(5-oxidanyl-4-oxidanylidene-3,7-diphenoxy-chromen-2-yl)-2-phenoxy-phenoxy]methyl butanoate

Systemtic Name: [5-(5-oxidanyl-4-oxidanylidene-3,7-diphenoxy-chromen-2-yl)-2-phenoxy-phenoxy]methyl butanoate Openeye Name: [5-(5-hydroxy-4-oxo-3,7-diphenoxy-chromen-2-yl)-2-phenoxy-phenoxy]methyl butanoate CAS Name: butanoic acid [5-(5-hydroxy-4-oxo-3,7-diphenoxy-1-benzopyran-2-yl)-2-phenoxyphenoxy]methyl ester IUPAC Name: [5-(5-hydroxy-4-oxo-3,7-diphenoxychromen-2-yl)-2-phenoxyphenoxy]methyl butanoate Traditional Name: butyric acid [5-(5-hydroxy-4-keto-3,7-diphenoxy-chromen-2-yl)-2-phenoxy-phenoxy]methyl ester Formula: C38H30O9 MolecularWeight: 630.6394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCOC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4=CC=CC=C4)O)OC5=CC=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

CCCC(=O)OCOC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4=CC=CC=C4)O)OC5=CC=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C38H30O9/c1-2-12-34(40)43-24-42-32-21-25(19-20-31(32)45-27-15-8-4-9-16-27)37-38(46-28-17-10-5-11-18-28)36(41)35-30(39)22-29(23-33(35)47-37)44-26-13-6-3-7-14-26/h3-11,13-23,39H,2,12,24H2,1H3