(4E)-3-methyl-4-(pyridin-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylic acid

Systemtic Name: (4E)-3-methyl-4-(pyridin-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylic acid Openeye Name: (4E)-3-methyl-4-(pyridine-2-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid CAS Name: (4E)-3-methyl-4-[[oxo(2-pyridinyl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid IUPAC Name: (4E)-3-methyl-4-(pyridine-2-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylic acid Traditional Name: (4E)-3-methyl-4-(picolinoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CC=N3)CCC2)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CC=N3)/CCC2)C(=O)O

InChI

InChI=1S/C16H15N3O4/c1-9-13-10(6-4-7-12(13)23-14(9)16(21)22)18-19-15(20)11-5-2-3-8-17-11/h2-3,5,8H,4,6-7H2,1H3,(H,19,20)(H,21,22)/b18-10+