naphthalen-2-yl (4E)-3-methyl-4-(pyridin-4-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: naphthalen-2-yl (4E)-3-methyl-4-(pyridin-4-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 2-naphthyl (4E)-3-methyl-4-(pyridine-4-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl (4E)-3-methyl-4-(pyridine-4-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-(isonicotinoylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 2-naphthyl ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=NC=C3)CCC2)C(=O)OC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=NC=C3)/CCC2)C(=O)OC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H21N3O4/c1-16-23-21(28-29-25(30)18-11-13-27-14-12-18)7-4-8-22(23)33-24(16)26(31)32-20-10-9-17-5-2-3-6-19(17)15-20/h2-3,5-6,9-15H,4,7-8H2,1H3,(H,29,30)/b28-21+