2-[3-(4-methylpentoxy)-2-oxidanyl-4-oxidanylidene-chromen-5-yl]oxyethanoic acid

Systemtic Name: 2-[3-(4-methylpentoxy)-2-oxidanyl-4-oxidanylidene-chromen-5-yl]oxyethanoic acid Openeye Name: 2-(2-hydroxy-3-isohexyloxy-4-oxo-chromen-5-yl)oxyacetic acid CAS Name: 2-[[2-hydroxy-3-(4-methylpentoxy)-4-oxo-1-benzopyran-5-yl]oxy]acetic acid IUPAC Name: 2-[2-hydroxy-3-(4-methylpentoxy)-4-oxochromen-5-yl]oxyacetic acid Traditional Name: 2-(2-hydroxy-3-isohexyloxy-4-keto-chromen-5-yl)oxyacetic acid Formula: C17H20O7 MolecularWeight: 336.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCC(=O)O)O

Isomeric SMILES

CC(C)CCCOC1=C(OC2=C(C1=O)C(=CC=C2)OCC(=O)O)O

InChI

InChI=1S/C17H20O7/c1-10(2)5-4-8-22-16-15(20)14-11(23-9-13(18)19)6-3-7-12(14)24-17(16)21/h3,6-7,10,21H,4-5,8-9H2,1-2H3,(H,18,19)