[2-acetyloxy-4-(6-hexadecoxy-5,7-dimethoxy-4-oxidanylidene-chromen-2-yl)phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-(6-hexadecoxy-5,7-dimethoxy-4-oxidanylidene-chromen-2-yl)phenyl] ethanoate Openeye Name: [2-acetoxy-4-(6-hexadecoxy-5,7-dimethoxy-4-oxo-chromen-2-yl)phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-(6-hexadecoxy-5,7-dimethoxy-4-oxo-1-benzopyran-2-yl)phenyl] ester IUPAC Name: [2-acetyloxy-4-(6-hexadecoxy-5,7-dimethoxy-4-oxochromen-2-yl)phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-(6-cetyloxy-4-keto-5,7-dimethoxy-chromen-2-yl)phenyl] ester Formula: C37H50O9 MolecularWeight: 638.7875

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C2C(=C1OC)C(=O)C=C(O2)C3=CC(=C(C=C3)OC(=O)C)OC(=O)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C2C(=C1OC)C(=O)C=C(O2)C3=CC(=C(C=C3)OC(=O)C)OC(=O)C)OC

InChI

InChI=1S/C37H50O9/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-43-36-34(41-4)25-33-35(37(36)42-5)29(40)24-31(46-33)28-20-21-30(44-26(2)38)32(23-28)45-27(3)39/h20-21,23-25H,6-19,22H2,1-5H3