2-[[(4R)-4-(3-butoxyphenyl)-2-oxidanylidene-3,4-dihydrochromen-7-yl]oxy]ethanoate

Systemtic Name: 2-[[(4R)-4-(3-butoxyphenyl)-2-oxidanylidene-3,4-dihydrochromen-7-yl]oxy]ethanoate Openeye Name: 2-[(4R)-4-(3-butoxyphenyl)-2-oxo-chroman-7-yl]oxyacetate CAS Name: 2-[[(4R)-4-(3-butoxyphenyl)-2-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy]acetate IUPAC Name: 2-[[(4R)-4-(3-butoxyphenyl)-2-oxo-3,4-dihydrochromen-7-yl]oxy]acetate Traditional Name: 2-[(4R)-4-(3-butoxyphenyl)-2-keto-chroman-7-yl]oxyacetate Formula: C21H21O6- MolecularWeight: 369.38784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2CC(=O)OC3=C2C=CC(=C3)OCC(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=CC(=C1)[C@H]2CC(=O)OC3=C2C=CC(=C3)OCC(=O)[O-]

InChI

InChI=1S/C21H22O6/c1-2-3-9-25-15-6-4-5-14(10-15)18-12-21(24)27-19-11-16(7-8-17(18)19)26-13-20(22)23/h4-8,10-11,18H,2-3,9,12-13H2,1H3,(H,22,23)/p-1/t18-/m1/s1