tert-butyl 2-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate

Systemtic Name: tert-butyl 2-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate Openeye Name: tert-butyl 2-[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate CAS Name: 2-[[(2Z)-7-methyl-2-[(1-methyl-3-indolyl)methylidene]-3-oxo-6-benzofuranyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate Traditional Name: 2-[(2Z)-3-keto-7-methyl-2-[(1-methylindol-3-yl)methylene]coumaran-6-yl]oxyacetic acid tert-butyl ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)C)C2=O)OCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1O/C(=C\C3=CN(C4=CC=CC=C43)C)/C2=O)OCC(=O)OC(C)(C)C

InChI

InChI=1S/C25H25NO5/c1-15-20(29-14-22(27)31-25(2,3)4)11-10-18-23(28)21(30-24(15)18)12-16-13-26(5)19-9-7-6-8-17(16)19/h6-13H,14H2,1-5H3/b21-12-