7-(diethylaminomethyl)-2-[(4-nitrophenyl)methylidene]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: 7-(diethylaminomethyl)-2-[(4-nitrophenyl)methylidene]-6-oxidanyl-1-benzofuran-3-one Openeye Name: 7-(diethylaminomethyl)-6-hydroxy-2-[(4-nitrophenyl)methylene]benzofuran-3-one CAS Name: 7-(diethylaminomethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-3-benzofuranone IUPAC Name: 7-(diethylaminomethyl)-6-hydroxy-2-[(4-nitrophenyl)methylidene]-1-benzofuran-3-one Traditional Name: 7-(diethylaminomethyl)-6-hydroxy-2-(4-nitrobenzylidene)coumaran-3-one Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=O)O

Isomeric SMILES

CCN(CC)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=O)O

InChI

InChI=1S/C20H20N2O5/c1-3-21(4-2)12-16-17(23)10-9-15-19(24)18(27-20(15)16)11-13-5-7-14(8-6-13)22(25)26/h5-11,23H,3-4,12H2,1-2H3