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

Systemtic Name: (4E)-N-butan-2-yl-4-[(4-chloranyl-3-nitro-phenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-N-sec-butyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N-butan-2-yl-4-[[(4-chloro-3-nitrophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N-butan-2-yl-4-[(4-chloro-3-nitrobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-N-sec-butyl-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C21H23ClN4O5 MolecularWeight: 446.88412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN4O5/c1-4-11(2)23-21(28)19-12(3)18-15(6-5-7-17(18)31-19)24-25-20(27)13-8-9-14(22)16(10-13)26(29)30/h8-11H,4-7H2,1-3H3,(H,23,28)(H,25,27)/b24-15+