2-[cyanomethyl-[[2-[3-(2-methoxyphenyl)prop-2-enylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]amino]ethanenitrile

Systemtic Name: 2-[cyanomethyl-[[2-[3-(2-methoxyphenyl)prop-2-enylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]amino]ethanenitrile Openeye Name: 2-[cyanomethyl-[[6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-3-oxo-benzofuran-7-yl]methyl]amino]acetonitrile CAS Name: 2-[cyanomethyl-[[6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-3-oxo-7-benzofuranyl]methyl]amino]acetonitrile IUPAC Name: 2-[cyanomethyl-[[6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-3-oxo-1-benzofuran-7-yl]methyl]amino]acetonitrile Traditional Name: 2-[cyanomethyl-[[6-hydroxy-3-keto-2-[3-(2-methoxyphenyl)prop-2-enylidene]coumaran-7-yl]methyl]amino]acetonitrile Formula: C23H19N3O4 MolecularWeight: 401.41466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN(CC#N)CC#N

Isomeric SMILES

COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN(CC#N)CC#N

InChI

InChI=1S/C23H19N3O4/c1-29-20-7-3-2-5-16(20)6-4-8-21-22(28)17-9-10-19(27)18(23(17)30-21)15-26(13-11-24)14-12-25/h2-10,27H,13-15H2,1H3