(4E)-N-butan-2-yl-3-methyl-4-[(3-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-N-butan-2-yl-3-methyl-4-[(3-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-3-methyl-4-[(3-nitrobenzoyl)hydrazono]-N-sec-butyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N-butan-2-yl-3-methyl-4-[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N-butan-2-yl-3-methyl-4-[(3-nitrobenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-3-methyl-4-[(3-nitrobenzoyl)hydrazono]-N-sec-butyl-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C2=C(O1)CCCC2=NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C)NC(=O)C1=C(C\2=C(O1)CCC/C2=N\NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H24N4O5/c1-4-12(2)22-21(27)19-13(3)18-16(9-6-10-17(18)30-19)23-24-20(26)14-7-5-8-15(11-14)25(28)29/h5,7-8,11-12H,4,6,9-10H2,1-3H3,(H,22,27)(H,24,26)/b23-16+