(4E)-N,N-bis(cyanomethyl)-3-methyl-4-(2-phenylethanoylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-(2-phenylethanoylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(1-oxo-2-phenylethyl)hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(2-phenylacetyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)CC3=CC=CC=C3)CCC2)C(=O)N(CC#N)CC#N

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)CC3=CC=CC=C3)/CCC2)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C22H21N5O3/c1-15-20-17(25-26-19(28)14-16-6-3-2-4-7-16)8-5-9-18(20)30-21(15)22(29)27(12-10-23)13-11-24/h2-4,6-7H,5,8-9,12-14H2,1H3,(H,26,28)/b25-17+