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

Systemtic Name: 2-[2-[(4-bromanyl-2-methyl-phenyl)amino]but-3-ynoxy]-3,4-bis(fluoranyl)benzamide Openeye Name: 2-[2-(4-bromo-2-methyl-anilino)but-3-ynoxy]-3,4-difluoro-benzamide CAS Name: 2-[2-(4-bromo-2-methylanilino)but-3-ynoxy]-3,4-difluorobenzamide IUPAC Name: 2-[2-(4-bromo-2-methylanilino)but-3-ynoxy]-3,4-difluorobenzamide Traditional Name: 2-[2-(4-bromo-2-methyl-anilino)but-3-ynoxy]-3,4-difluoro-benzamide Formula: C18H15BrF2N2O2 MolecularWeight: 409.224706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(COC2=C(C=CC(=C2F)F)C(=O)N)C#C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(COC2=C(C=CC(=C2F)F)C(=O)N)C#C

InChI

InChI=1S/C18H15BrF2N2O2/c1-3-12(23-15-7-4-11(19)8-10(15)2)9-25-17-13(18(22)24)5-6-14(20)16(17)21/h1,4-8,12,23H,9H2,2H3,(H2,22,24)