4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide

Systemtic Name: 4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Openeye Name: 4-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide CAS Name: 4-[2-(4-bromo-2-fluoroanilino)-2-oxoethoxy]-N-(2,5-dimethyl-1-pyrrolyl)benzamide IUPAC Name: 4-[2-(4-bromo-2-fluoroanilino)-2-oxoethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Traditional Name: 4-[2-(4-bromo-2-fluoro-anilino)-2-keto-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Formula: C21H19BrFN3O3 MolecularWeight: 460.296263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=C(C=C(C=C3)Br)F)C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=C(C=C(C=C3)Br)F)C

InChI

InChI=1S/C21H19BrFN3O3/c1-13-3-4-14(2)26(13)25-21(28)15-5-8-17(9-6-15)29-12-20(27)24-19-10-7-16(22)11-18(19)23/h3-11H,12H2,1-2H3,(H,24,27)(H,25,28)