3-(3-octoxy-2-oxidanyl-4-oxidanylidene-chromen-6-yl)oxypropyl ethanoate

Systemtic Name: 3-(3-octoxy-2-oxidanyl-4-oxidanylidene-chromen-6-yl)oxypropyl ethanoate Openeye Name: 3-(2-hydroxy-3-octoxy-4-oxo-chromen-6-yl)oxypropyl acetate CAS Name: acetic acid 3-[(2-hydroxy-3-octoxy-4-oxo-1-benzopyran-6-yl)oxy]propyl ester IUPAC Name: 3-(2-hydroxy-3-octoxy-4-oxochromen-6-yl)oxypropyl acetate Traditional Name: acetic acid 3-(2-hydroxy-4-keto-3-octoxy-chromen-6-yl)oxypropyl ester Formula: C22H30O7 MolecularWeight: 406.4694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(OC2=C(C1=O)C=C(C=C2)OCCCOC(=O)C)O

Isomeric SMILES

CCCCCCCCOC1=C(OC2=C(C1=O)C=C(C=C2)OCCCOC(=O)C)O

InChI

InChI=1S/C22H30O7/c1-3-4-5-6-7-8-12-28-21-20(24)18-15-17(10-11-19(18)29-22(21)25)27-14-9-13-26-16(2)23/h10-11,15,25H,3-9,12-14H2,1-2H3