5-bromanyl-N-but-3-ynoxy-3,4-bis(fluoranyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide

Systemtic Name: 5-bromanyl-N-but-3-ynoxy-3,4-bis(fluoranyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide Openeye Name: 5-bromo-N-but-3-ynoxy-3,4-difluoro-2-(4-iodo-2-methyl-anilino)benzamide CAS Name: 5-bromo-N-but-3-ynoxy-3,4-difluoro-2-(4-iodo-2-methylanilino)benzamide IUPAC Name: 5-bromo-N-but-3-ynoxy-3,4-difluoro-2-(4-iodo-2-methylanilino)benzamide Traditional Name: 5-bromo-N-but-3-ynoxy-3,4-difluoro-2-(4-iodo-2-methyl-anilino)benzamide Formula: C18H14BrF2IN2O2 MolecularWeight: 535.121236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NOCCC#C)Br)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NOCCC#C)Br)F)F

InChI

InChI=1S/C18H14BrF2IN2O2/c1-3-4-7-26-24-18(25)12-9-13(19)15(20)16(21)17(12)23-14-6-5-11(22)8-10(14)2/h1,5-6,8-9,23H,4,7H2,2H3,(H,24,25)