2-(3-hexoxy-2-oxidanyl-4-oxidanylidene-chromen-6-yl)oxyethanoic acid

Systemtic Name: 2-(3-hexoxy-2-oxidanyl-4-oxidanylidene-chromen-6-yl)oxyethanoic acid Openeye Name: 2-(3-hexoxy-2-hydroxy-4-oxo-chromen-6-yl)oxyacetic acid CAS Name: 2-[(3-hexoxy-2-hydroxy-4-oxo-1-benzopyran-6-yl)oxy]acetic acid IUPAC Name: 2-(3-hexoxy-2-hydroxy-4-oxochromen-6-yl)oxyacetic acid Traditional Name: 2-(3-hexoxy-2-hydroxy-4-keto-chromen-6-yl)oxyacetic acid Formula: C17H20O7 MolecularWeight: 336.3365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(OC2=C(C1=O)C=C(C=C2)OCC(=O)O)O

Isomeric SMILES

CCCCCCOC1=C(OC2=C(C1=O)C=C(C=C2)OCC(=O)O)O

InChI

InChI=1S/C17H20O7/c1-2-3-4-5-8-22-16-15(20)12-9-11(23-10-14(18)19)6-7-13(12)24-17(16)21/h6-7,9,21H,2-5,8,10H2,1H3,(H,18,19)