4-(3-hexoxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxybutyl ethanoate

Systemtic Name: 4-(3-hexoxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxybutyl ethanoate Openeye Name: 4-(3-hexoxy-2-hydroxy-4-oxo-chromen-7-yl)oxybutyl acetate CAS Name: acetic acid 4-[(3-hexoxy-2-hydroxy-4-oxo-1-benzopyran-7-yl)oxy]butyl ester IUPAC Name: 4-(3-hexoxy-2-hydroxy-4-oxochromen-7-yl)oxybutyl acetate Traditional Name: acetic acid 4-(3-hexoxy-2-hydroxy-4-keto-chromen-7-yl)oxybutyl ester Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OCCCCOC(=O)C)O

Isomeric SMILES

CCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OCCCCOC(=O)C)O

InChI

InChI=1S/C21H28O7/c1-3-4-5-6-13-27-20-19(23)17-10-9-16(14-18(17)28-21(20)24)26-12-8-7-11-25-15(2)22/h9-10,14,24H,3-8,11-13H2,1-2H3