3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-nitro-3H-2-benzofuran-1-one

Systemtic Name: 3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-nitro-3H-2-benzofuran-1-one Openeye Name: 3-(2-morpholino-2-oxo-ethyl)-6-nitro-3H-isobenzofuran-1-one CAS Name: 3-[2-(4-morpholinyl)-2-oxoethyl]-6-nitro-3H-isobenzofuran-1-one IUPAC Name: 3-(2-morpholin-4-yl-2-oxoethyl)-6-nitro-3H-2-benzofuran-1-one Traditional Name: 3-(2-keto-2-morpholino-ethyl)-6-nitro-phthalide Formula: C14H14N2O6 MolecularWeight: 306.27076

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O2

Isomeric SMILES

C1COCCN1C(=O)CC2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O2

InChI

InChI=1S/C14H14N2O6/c17-13(15-3-5-21-6-4-15)8-12-10-2-1-9(16(19)20)7-11(10)14(18)22-12/h1-2,7,12H,3-6,8H2