methyl 2-(6-hexyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate

Systemtic Name: methyl 2-(6-hexyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate Openeye Name: methyl 2-(6-hexyl-7-hydroxy-2-oxo-chromen-4-yl)acetate CAS Name: 2-(6-hexyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-hexyl-7-hydroxy-2-oxochromen-4-yl)acetate Traditional Name: 2-(6-hexyl-7-hydroxy-2-keto-chromen-4-yl)acetic acid methyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)OC)O

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)OC)O

InChI

InChI=1S/C18H22O5/c1-3-4-5-6-7-12-8-14-13(9-17(20)22-2)10-18(21)23-16(14)11-15(12)19/h8,10-11,19H,3-7,9H2,1-2H3