methyl (2R)-2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoate

Systemtic Name: methyl (2R)-2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoate Openeye Name: methyl (2R)-2-(3-hexyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxypropanoate CAS Name: (2R)-2-[(3-hexyl-4,8-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(3-hexyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoate Traditional Name: (2R)-2-(3-hexyl-2-keto-4,8-dimethyl-chromen-7-yl)oxypropionic acid methyl ester Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OC(C)C(=O)OC)C)OC1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H28O5/c1-6-7-8-9-10-17-13(2)16-11-12-18(25-15(4)20(22)24-5)14(3)19(16)26-21(17)23/h11-12,15H,6-10H2,1-5H3/t15-/m1/s1