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

Systemtic Name: (4E)-3-methyl-N-(3-methylbutyl)-4-[(3-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N-isopentyl-3-methyl-4-[(3-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-3-methyl-N-(3-methylbutyl)-4-[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-3-methyl-N-(3-methylbutyl)-4-[(3-nitrobenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N-isoamyl-3-methyl-4-[(3-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CCC2)C(=O)NCCC(C)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])/CCC2)C(=O)NCCC(C)C

InChI

InChI=1S/C22H26N4O5/c1-13(2)10-11-23-22(28)20-14(3)19-17(8-5-9-18(19)31-20)24-25-21(27)15-6-4-7-16(12-15)26(29)30/h4,6-7,12-13H,5,8-11H2,1-3H3,(H,23,28)(H,25,27)/b24-17+