(2Z)-6-(2-morpholin-4-ylethoxy)-2-[(5-nitrothiophen-2-yl)methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-6-(2-morpholin-4-ylethoxy)-2-[(5-nitrothiophen-2-yl)methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-6-(2-morpholinoethoxy)-2-[(5-nitro-2-thienyl)methylene]benzofuran-3-one CAS Name: (2Z)-6-[2-(4-morpholinyl)ethoxy]-2-[(5-nitro-2-thiophenyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-6-(2-morpholin-4-ylethoxy)-2-[(5-nitrothiophen-2-yl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-6-(2-morpholinoethoxy)-2-[(5-nitro-2-thienyl)methylene]coumaran-3-one Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(S4)[N+](=O)[O-])O3

Isomeric SMILES

C1COCCN1CCOC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=C(S4)[N+](=O)[O-])/O3

InChI

InChI=1S/C19H18N2O6S/c22-19-15-3-1-13(26-10-7-20-5-8-25-9-6-20)11-16(15)27-17(19)12-14-2-4-18(28-14)21(23)24/h1-4,11-12H,5-10H2/b17-12-