methyl (2R)-2-(6-hexyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxypropanoate

Systemtic Name: methyl (2R)-2-(6-hexyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxypropanoate Openeye Name: methyl (2R)-2-(6-hexyl-2-oxo-4-phenyl-chromen-7-yl)oxypropanoate CAS Name: (2R)-2-[(6-hexyl-2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(6-hexyl-2-oxo-4-phenylchromen-7-yl)oxypropanoate Traditional Name: (2R)-2-(6-hexyl-2-keto-4-phenyl-chromen-7-yl)oxypropionic acid methyl ester Formula: C25H28O5 MolecularWeight: 408.48682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OC(C)C(=O)OC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)O[C@H](C)C(=O)OC

InChI

InChI=1S/C25H28O5/c1-4-5-6-8-13-19-14-21-20(18-11-9-7-10-12-18)15-24(26)30-23(21)16-22(19)29-17(2)25(27)28-3/h7,9-12,14-17H,4-6,8,13H2,1-3H3/t17-/m1/s1