(2S)-2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxy-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxy-2-phenyl-ethanoate Openeye Name: (2S)-2-(2-oxo-4-propyl-chromen-7-yl)oxy-2-phenyl-acetate CAS Name: (2S)-2-[(2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-2-phenylacetate IUPAC Name: (2S)-2-(2-oxo-4-propylchromen-7-yl)oxy-2-phenylacetate Traditional Name: (2S)-2-(2-keto-4-propyl-chromen-7-yl)oxy-2-phenyl-acetate Formula: C20H17O5- MolecularWeight: 337.34598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)O[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H18O5/c1-2-6-14-11-18(21)25-17-12-15(9-10-16(14)17)24-19(20(22)23)13-7-4-3-5-8-13/h3-5,7-12,19H,2,6H2,1H3,(H,22,23)/p-1/t19-/m0/s1