methyl 4-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[(2Z)-2-[(1-ethylindol-3-yl)methylene]-7-methyl-3-oxo-benzofuran-6-yl]oxymethyl]benzoate CAS Name: 4-[[(2Z)-2-[(1-ethyl-3-indolyl)methylidene]-7-methyl-3-oxo-6-benzofuranyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate Traditional Name: 4-[[(2Z)-2-[(1-ethylindol-3-yl)methylene]-3-keto-7-methyl-coumaran-6-yl]oxymethyl]benzoic acid methyl ester Formula: C29H25NO5 MolecularWeight: 467.5125

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C(=C(C=C4)OCC5=CC=C(C=C5)C(=O)OC)C

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)/C=C\3/C(=O)C4=C(O3)C(=C(C=C4)OCC5=CC=C(C=C5)C(=O)OC)C

InChI

InChI=1S/C29H25NO5/c1-4-30-16-21(22-7-5-6-8-24(22)30)15-26-27(31)23-13-14-25(18(2)28(23)35-26)34-17-19-9-11-20(12-10-19)29(32)33-3/h5-16H,4,17H2,1-3H3/b26-15-