2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-[3-tert-butyl-5-(dimethylamino)-4-oxidanyl-phenyl]ethanone

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-1-[3-tert-butyl-5-(dimethylamino)-4-oxidanyl-phenyl]ethanone Openeye Name: 1-[3-tert-butyl-5-(dimethylamino)-4-hydroxy-phenyl]-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone CAS Name: 1-[3-tert-butyl-5-(dimethylamino)-4-hydroxyphenyl]-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone IUPAC Name: 1-[3-tert-butyl-5-(dimethylamino)-4-hydroxyphenyl]-2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)ethanone Traditional Name: 1-[3-tert-butyl-5-(dimethylamino)-4-hydroxy-phenyl]-2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)ethanone Formula: C26H34FN3O4 MolecularWeight: 471.564263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)N(C)C)O)C(C)(C)C)F)OCC

Isomeric SMILES

CCOC1=C(C(=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)N(C)C)O)C(C)(C)C)F)OCC

InChI

InChI=1S/C26H34FN3O4/c1-8-33-20-12-16-13-30(25(28)21(16)22(27)24(20)34-9-2)14-19(31)15-10-17(26(3,4)5)23(32)18(11-15)29(6)7/h10-12,28,32H,8-9,13-14H2,1-7H3