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

Systemtic Name: methyl 4-[[(2Z)-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[(2Z)-2-[(1-methylindol-3-yl)methylene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate CAS Name: 4-[[(2Z)-2-[(1-methyl-3-indolyl)methylidene]-3-oxo-6-benzofuranyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2Z)-2-[(1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate Traditional Name: 4-[[(2Z)-3-keto-2-[(1-methylindol-3-yl)methylene]coumaran-6-yl]oxymethyl]benzoic acid methyl ester Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CN1C=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

InChI

InChI=1S/C27H21NO5/c1-28-15-19(21-5-3-4-6-23(21)28)13-25-26(29)22-12-11-20(14-24(22)33-25)32-16-17-7-9-18(10-8-17)27(30)31-2/h3-15H,16H2,1-2H3/b25-13-