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

Systemtic Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(3-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(3-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[[(3-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-[(3-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-N,N-bis(cyanomethyl)-3-methyl-4-(m-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)N(CC#N)CC#N)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)N(CC#N)CC#N)C

InChI

InChI=1S/C22H21N5O3/c1-14-5-3-6-16(13-14)21(28)26-25-17-7-4-8-18-19(17)15(2)20(30-18)22(29)27(11-9-23)12-10-24/h3,5-6,13H,4,7-8,11-12H2,1-2H3,(H,26,28)/b25-17+