3-[4-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methyl-phenyl]imino-7-iodanyl-2-benzofuran-1-one

Systemtic Name: 3-[4-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methyl-phenyl]imino-7-iodanyl-2-benzofuran-1-one Openeye Name: 3-[4-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methyl-phenyl]imino-7-iodo-isobenzofuran-1-one CAS Name: 3-[4-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methylphenyl]imino-7-iodo-1-isobenzofuranone IUPAC Name: 3-[4-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methylphenyl]imino-7-iodo-2-benzofuran-1-one Traditional Name: 3-[4-[3,5-bis(trifluoromethyl)benzyl]-2-methyl-phenyl]imino-7-iodo-phthalide Formula: C24H14F6INO2 MolecularWeight: 589.268349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N=C3C4=C(C(=CC=C4)I)C(=O)O3

Isomeric SMILES

CC1=C(C=CC(=C1)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N=C3C4=C(C(=CC=C4)I)C(=O)O3

InChI

InChI=1S/C24H14F6INO2/c1-12-7-13(8-14-9-15(23(25,26)27)11-16(10-14)24(28,29)30)5-6-19(12)32-21-17-3-2-4-18(31)20(17)22(33)34-21/h2-7,9-11H,8H2,1H3