4-[4-[2-fluoranyl-4-(3-methylbut-2-enylamino)phenyl]-3,6-dimethoxy-2-oxidanyl-phenyl]benzene-1,2-diol

Systemtic Name: 4-[4-[2-fluoranyl-4-(3-methylbut-2-enylamino)phenyl]-3,6-dimethoxy-2-oxidanyl-phenyl]benzene-1,2-diol Openeye Name: 4-[4-[2-fluoro-4-(3-methylbut-2-enylamino)phenyl]-2-hydroxy-3,6-dimethoxy-phenyl]benzene-1,2-diol CAS Name: 4-[4-[2-fluoro-4-(3-methylbut-2-enylamino)phenyl]-2-hydroxy-3,6-dimethoxyphenyl]benzene-1,2-diol IUPAC Name: 4-[4-[2-fluoro-4-(3-methylbut-2-enylamino)phenyl]-2-hydroxy-3,6-dimethoxyphenyl]benzene-1,2-diol Traditional Name: 4-[4-[2-fluoro-4-(3-methylbut-2-enylamino)phenyl]-2-hydroxy-3,6-dimethoxy-phenyl]pyrocatechol Formula: C25H26FNO5 MolecularWeight: 439.476043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCNC1=CC(=C(C=C1)C2=CC(=C(C(=C2OC)O)C3=CC(=C(C=C3)O)O)OC)F)C

Isomeric SMILES

CC(=CCNC1=CC(=C(C=C1)C2=CC(=C(C(=C2OC)O)C3=CC(=C(C=C3)O)O)OC)F)C

InChI

InChI=1S/C25H26FNO5/c1-14(2)9-10-27-16-6-7-17(19(26)12-16)18-13-22(31-3)23(24(30)25(18)32-4)15-5-8-20(28)21(29)11-15/h5-9,11-13,27-30H,10H2,1-4H3