(2E)-2-[[[5-bromanyl-2-(4-chlorophenyl)carbonyl-1-benzofuran-3-yl]amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-[[[5-bromanyl-2-(4-chlorophenyl)carbonyl-1-benzofuran-3-yl]amino]-oxidanyl-methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-[[[5-bromo-2-(4-chlorobenzoyl)benzofuran-3-yl]amino]-hydroxy-methylene]-3-oxo-butanenitrile CAS Name: (2E)-2-[[[5-bromo-2-[(4-chlorophenyl)-oxomethyl]-3-benzofuranyl]amino]-hydroxymethylidene]-3-oxobutanenitrile IUPAC Name: (2E)-2-[[[5-bromo-2-(4-chlorobenzoyl)-1-benzofuran-3-yl]amino]-hydroxymethylidene]-3-oxobutanenitrile Traditional Name: (E)-2-acetyl-3-[[5-bromo-2-(4-chlorobenzoyl)benzofuran-3-yl]amino]-3-hydroxy-acrylonitrile Formula: C20H12BrClN2O4 MolecularWeight: 459.67728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(NC1=C(OC2=C1C=C(C=C2)Br)C(=O)C3=CC=C(C=C3)Cl)O)C#N

Isomeric SMILES

CC(=O)/C(=C(\NC1=C(OC2=C1C=C(C=C2)Br)C(=O)C3=CC=C(C=C3)Cl)/O)/C#N

InChI

InChI=1S/C20H12BrClN2O4/c1-10(25)15(9-23)20(27)24-17-14-8-12(21)4-7-16(14)28-19(17)18(26)11-2-5-13(22)6-3-11/h2-8,24,27H,1H3/b20-15+