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

Systemtic Name: (4E)-4-[(4-chloranyl-3-nitro-phenyl)carbonylhydrazinylidene]-3-methyl-N-(pyridin-3-ylmethyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-N-(3-pyridylmethyl)-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-[[(4-chloro-3-nitrophenyl)-oxomethyl]hydrazinylidene]-3-methyl-N-(3-pyridinylmethyl)-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-4-[(4-chloro-3-nitrobenzoyl)hydrazinylidene]-3-methyl-N-(pyridin-3-ylmethyl)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-N-(3-pyridylmethyl)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C23H20ClN5O5 MolecularWeight: 481.8884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])CCC2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])/CCC2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C23H20ClN5O5/c1-13-20-17(27-28-22(30)15-7-8-16(24)18(10-15)29(32)33)5-2-6-19(20)34-21(13)23(31)26-12-14-4-3-9-25-11-14/h3-4,7-11H,2,5-6,12H2,1H3,(H,26,31)(H,28,30)/b27-17+