2-(3-octoxy-2-oxidanyl-4-oxidanylidene-chromen-5-yl)oxyethyl ethanoate

Systemtic Name: 2-(3-octoxy-2-oxidanyl-4-oxidanylidene-chromen-5-yl)oxyethyl ethanoate Openeye Name: 2-(2-hydroxy-3-octoxy-4-oxo-chromen-5-yl)oxyethyl acetate CAS Name: acetic acid 2-[(2-hydroxy-3-octoxy-4-oxo-1-benzopyran-5-yl)oxy]ethyl ester IUPAC Name: 2-(2-hydroxy-3-octoxy-4-oxochromen-5-yl)oxyethyl acetate Traditional Name: acetic acid 2-(2-hydroxy-4-keto-3-octoxy-chromen-5-yl)oxyethyl ester Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCCOC(=O)C)O

Isomeric SMILES

CCCCCCCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCCOC(=O)C)O

InChI

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