[4-(7-octadecanoyloxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl)phenyl] octadecanoate

Systemtic Name: [4-(7-octadecanoyloxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl)phenyl] octadecanoate Openeye Name: [4-(5-hydroxy-7-octadecanoyloxy-4-oxo-chromen-3-yl)phenyl] octadecanoate CAS Name: octadecanoic acid [4-[5-hydroxy-4-oxo-7-(1-oxooctadecoxy)-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-(5-hydroxy-7-octadecanoyloxy-4-oxochromen-3-yl)phenyl] octadecanoate Traditional Name: stearic acid [4-(5-hydroxy-4-keto-7-stearoyloxy-chromen-3-yl)phenyl] ester Formula: C51H78O7 MolecularWeight: 803.16082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C51H78O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-48(53)57-43-37-35-42(36-38-43)45-41-56-47-40-44(39-46(52)50(47)51(45)55)58-49(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-41,52H,3-34H2,1-2H3