ethyl (2S)-2-[[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate

Systemtic Name: ethyl (2S)-2-[[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate Openeye Name: ethyl (2S)-2-[(2Z)-3-oxo-2-(p-tolylmethylene)benzofuran-6-yl]oxypropanoate CAS Name: (2S)-2-[[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]propanoate Traditional Name: (2S)-2-[(2Z)-3-keto-2-(4-methylbenzylidene)coumaran-6-yl]oxypropionic acid ethyl ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC=C(C=C3)C)O2

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC=C(C=C3)C)/O2

InChI

InChI=1S/C21H20O5/c1-4-24-21(23)14(3)25-16-9-10-17-18(12-16)26-19(20(17)22)11-15-7-5-13(2)6-8-15/h5-12,14H,4H2,1-3H3/b19-11-/t14-/m0/s1