6-bromanyl-N-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 6-bromo-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: 6-bromo-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 6-bromo-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C21H18BrFN2O3 MolecularWeight: 445.281623

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)Br)C(=O)O1)C(=O)NCCC3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

CC1(CC2=C(C=CC(=C2)Br)C(=O)O1)C(=O)NCCC3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H18BrFN2O3/c1-21(10-13-8-14(22)2-4-16(13)19(26)28-21)20(27)24-7-6-12-11-25-18-5-3-15(23)9-17(12)18/h2-5,8-9,11,25H,6-7,10H2,1H3,(H,24,27)