2-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanenitrile

Systemtic Name: 2-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanenitrile Openeye Name: 2-[(2Z)-2-[(1-ethylindol-3-yl)methylene]-7-methyl-3-oxo-benzofuran-6-yl]oxyacetonitrile CAS Name: 2-[[(2Z)-2-[(1-ethyl-3-indolyl)methylidene]-7-methyl-3-oxo-6-benzofuranyl]oxy]acetonitrile IUPAC Name: 2-[[(2Z)-2-[(1-ethylindol-3-yl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile Traditional Name: 2-[(2Z)-2-[(1-ethylindol-3-yl)methylene]-3-keto-7-methyl-coumaran-6-yl]oxyacetonitrile Formula: C22H18N2O3 MolecularWeight: 358.38992

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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)OCC#N)C

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)/C=C\3/C(=O)C4=C(O3)C(=C(C=C4)OCC#N)C

InChI

InChI=1S/C22H18N2O3/c1-3-24-13-15(16-6-4-5-7-18(16)24)12-20-21(25)17-8-9-19(26-11-10-23)14(2)22(17)27-20/h4-9,12-13H,3,11H2,1-2H3/b20-12-