(2R)-2-(4-methyl-2-oxidanylidene-3-pentyl-chromen-7-yl)oxybutanoate

Systemtic Name: (2R)-2-(4-methyl-2-oxidanylidene-3-pentyl-chromen-7-yl)oxybutanoate Openeye Name: (2R)-2-(4-methyl-2-oxo-3-pentyl-chromen-7-yl)oxybutanoate CAS Name: (2R)-2-[(4-methyl-2-oxo-3-pentyl-1-benzopyran-7-yl)oxy]butanoate IUPAC Name: (2R)-2-(4-methyl-2-oxo-3-pentylchromen-7-yl)oxybutanoate Traditional Name: (2R)-2-(3-amyl-2-keto-4-methyl-chromen-7-yl)oxybutyrate Formula: C19H23O5- MolecularWeight: 331.38292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C2=C(C=C(C=C2)OC(CC)C(=O)[O-])OC1=O)C

Isomeric SMILES

CCCCCC1=C(C2=C(C=C(C=C2)O[C@H](CC)C(=O)[O-])OC1=O)C

InChI

InChI=1S/C19H24O5/c1-4-6-7-8-15-12(3)14-10-9-13(11-17(14)24-19(15)22)23-16(5-2)18(20)21/h9-11,16H,4-8H2,1-3H3,(H,20,21)/p-1/t16-/m1/s1