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

Systemtic Name: [4-(7-hexanoyloxy-4-oxidanylidene-chromen-3-yl)phenyl] hexanoate Openeye Name: [4-(7-hexanoyloxy-4-oxo-chromen-3-yl)phenyl] hexanoate CAS Name: hexanoic acid [4-[4-oxo-7-(1-oxohexoxy)-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-(7-hexanoyloxy-4-oxochromen-3-yl)phenyl] hexanoate Traditional Name: hexanoic acid [4-(7-caproyloxy-4-keto-chromen-3-yl)phenyl] ester Formula: C27H30O6 MolecularWeight: 450.5235

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCCC

InChI

InChI=1S/C27H30O6/c1-3-5-7-9-25(28)32-20-13-11-19(12-14-20)23-18-31-24-17-21(15-16-22(24)27(23)30)33-26(29)10-8-6-4-2/h11-18H,3-10H2,1-2H3