(2R)-2-(3-hexyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoate

Systemtic Name: (2R)-2-(3-hexyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoate Openeye Name: (2R)-2-(3-hexyl-4-methyl-2-oxo-chromen-7-yl)oxypropanoate CAS Name: (2R)-2-[(3-hexyl-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]propanoate IUPAC Name: (2R)-2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxypropanoate Traditional Name: (2R)-2-(3-hexyl-2-keto-4-methyl-chromen-7-yl)oxypropionate Formula: C19H23O5- MolecularWeight: 331.38292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OC(C)C(=O)[O-])OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)O[C@H](C)C(=O)[O-])OC1=O)C

InChI

InChI=1S/C19H24O5/c1-4-5-6-7-8-16-12(2)15-10-9-14(23-13(3)18(20)21)11-17(15)24-19(16)22/h9-11,13H,4-8H2,1-3H3,(H,20,21)/p-1/t13-/m1/s1