methyl (2Z)-2-[[4-(diethylamino)phenyl]methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate

Systemtic Name: methyl (2Z)-2-[[4-(diethylamino)phenyl]methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[[4-(diethylamino)phenyl]methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[[4-(diethylamino)phenyl]methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[[4-(diethylamino)phenyl]methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-2-[4-(diethylamino)benzylidene]-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H21NO4/c1-4-22(5-2)16-9-6-14(7-10-16)12-19-20(23)17-13-15(21(24)25-3)8-11-18(17)26-19/h6-13H,4-5H2,1-3H3/b19-12-