[4-(5-hexanoyloxy-7-oxidanyl-4-oxidanylidene-chromen-3-yl)phenyl] hexanoate

Systemtic Name: [4-(5-hexanoyloxy-7-oxidanyl-4-oxidanylidene-chromen-3-yl)phenyl] hexanoate Openeye Name: [4-(5-hexanoyloxy-7-hydroxy-4-oxo-chromen-3-yl)phenyl] hexanoate CAS Name: hexanoic acid [4-[7-hydroxy-4-oxo-5-(1-oxohexoxy)-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-(5-hexanoyloxy-7-hydroxy-4-oxochromen-3-yl)phenyl] hexanoate Traditional Name: hexanoic acid [4-(5-caproyloxy-7-hydroxy-4-keto-chromen-3-yl)phenyl] ester Formula: C27H30O7 MolecularWeight: 466.5229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)OC(=O)CCCCC)O

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)OC(=O)CCCCC)O

InChI

InChI=1S/C27H30O7/c1-3-5-7-9-24(29)33-20-13-11-18(12-14-20)21-17-32-22-15-19(28)16-23(26(22)27(21)31)34-25(30)10-8-6-4-2/h11-17,28H,3-10H2,1-2H3