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

Systemtic Name: N-[3,4-bis(oxidanyl)butoxy]-5-bromanyl-4-fluoranyl-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide Openeye Name: 5-bromo-N-(3,4-dihydroxybutoxy)-4-fluoro-2-(4-iodo-2-methyl-anilino)benzamide CAS Name: 5-bromo-N-(3,4-dihydroxybutoxy)-4-fluoro-2-(4-iodo-2-methylanilino)benzamide IUPAC Name: 5-bromo-N-(3,4-dihydroxybutoxy)-4-fluoro-2-(4-iodo-2-methylanilino)benzamide Traditional Name: 5-bromo-N-(3,4-dihydroxybutoxy)-4-fluoro-2-(4-iodo-2-methyl-anilino)benzamide Formula: C18H19BrFIN2O4 MolecularWeight: 553.161333

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrFIN2O4/c1-10-6-11(21)2-3-16(10)22-17-8-15(20)14(19)7-13(17)18(26)23-27-5-4-12(25)9-24/h2-3,6-8,12,22,24-25H,4-5,9H2,1H3,(H,23,26)