(4E)-4-(furan-2-ylcarbonylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: (4E)-4-(furan-2-ylcarbonylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: (4E)-4-(furan-2-carbonylhydrazono)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid CAS Name: (4E)-4-[[2-furanyl(oxo)methyl]hydrazinylidene]-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid IUPAC Name: (4E)-4-(furan-2-carbonylhydrazinylidene)-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: (4E)-4-(2-furoylhydrazono)-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CO3)CC(C2)(C)C)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CO3)/CC(C2)(C)C)C(=O)O

InChI

InChI=1S/C17H18N2O5/c1-9-13-10(18-19-15(20)11-5-4-6-23-11)7-17(2,3)8-12(13)24-14(9)16(21)22/h4-6H,7-8H2,1-3H3,(H,19,20)(H,21,22)/b18-10+