(phenylmethyl) 2-[[(2Z)-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate

Systemtic Name: (phenylmethyl) 2-[[(2Z)-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoate Openeye Name: benzyl 2-[(2Z)-2-[(1-methylindol-3-yl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate CAS Name: 2-[[(2Z)-2-[(1-methyl-3-indolyl)methylidene]-3-oxo-6-benzofuranyl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(2Z)-2-[(1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate Traditional Name: 2-[(2Z)-3-keto-2-[(1-methylindol-3-yl)methylene]coumaran-6-yl]oxyacetic acid benzyl 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)OCC(=O)OCC5=CC=CC=C5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=C\3/C(=O)C4=C(O3)C=C(C=C4)OCC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H21NO5/c1-28-15-19(21-9-5-6-10-23(21)28)13-25-27(30)22-12-11-20(14-24(22)33-25)31-17-26(29)32-16-18-7-3-2-4-8-18/h2-15H,16-17H2,1H3/b25-13-