5-[(1,1,3,3,6-pentamethyl-2-benzofuran-5-yl)methyl]-N'-quinolin-2-yl-furan-2-carbohydrazide

Systemtic Name: 5-[(1,1,3,3,6-pentamethyl-2-benzofuran-5-yl)methyl]-N'-quinolin-2-yl-furan-2-carbohydrazide Openeye Name: 5-[(1,1,3,3,6-pentamethylisobenzofuran-5-yl)methyl]-N'-(2-quinolyl)furan-2-carbohydrazide CAS Name: 5-[(1,1,3,3,6-pentamethyl-5-isobenzofuranyl)methyl]-N'-(2-quinolinyl)-2-furancarbohydrazide IUPAC Name: 5-[(1,1,3,3,6-pentamethyl-2-benzofuran-5-yl)methyl]-N'-quinolin-2-ylfuran-2-carbohydrazide Traditional Name: 5-[(1,1,3,3,6-pentamethylphthalan-5-yl)methyl]-N'-(2-quinolyl)-2-furohydrazide Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(OC2(C)C)(C)C)CC3=CC=C(O3)C(=O)NNC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(C=C2C(=C1)C(OC2(C)C)(C)C)CC3=CC=C(O3)C(=O)NNC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H29N3O3/c1-17-14-21-22(28(4,5)34-27(21,2)3)16-19(17)15-20-11-12-24(33-20)26(32)31-30-25-13-10-18-8-6-7-9-23(18)29-25/h6-14,16H,15H2,1-5H3,(H,29,30)(H,31,32)