2-(3-decoxy-2-oxidanyl-4-oxidanylidene-chromen-5-yl)oxyethanoic acid

Systemtic Name: 2-(3-decoxy-2-oxidanyl-4-oxidanylidene-chromen-5-yl)oxyethanoic acid Openeye Name: 2-(3-decoxy-2-hydroxy-4-oxo-chromen-5-yl)oxyacetic acid CAS Name: 2-[(3-decoxy-2-hydroxy-4-oxo-1-benzopyran-5-yl)oxy]acetic acid IUPAC Name: 2-(3-decoxy-2-hydroxy-4-oxochromen-5-yl)oxyacetic acid Traditional Name: 2-(3-decoxy-2-hydroxy-4-keto-chromen-5-yl)oxyacetic acid Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCC(=O)O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCC(=O)O)O

InChI

InChI=1S/C21H28O7/c1-2-3-4-5-6-7-8-9-13-26-20-19(24)18-15(27-14-17(22)23)11-10-12-16(18)28-21(20)25/h10-12,25H,2-9,13-14H2,1H3,(H,22,23)