methyl 3-[[(2S)-2-bromanylhexanoyl]amino]-5-fluoranyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[[(2S)-2-bromanylhexanoyl]amino]-5-fluoranyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[(2S)-2-bromohexanoyl]amino]-5-fluoro-1H-indole-2-carboxylate CAS Name: 3-[[(2S)-2-bromo-1-oxohexyl]amino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-bromohexanoyl]amino]-5-fluoro-1H-indole-2-carboxylate Traditional Name: 3-[[(2S)-2-bromohexanoyl]amino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester Formula: C16H18BrFN2O3 MolecularWeight: 385.228123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)OC)Br

Isomeric SMILES

CCCC[C@@H](C(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)OC)Br

InChI

InChI=1S/C16H18BrFN2O3/c1-3-4-5-11(17)15(21)20-13-10-8-9(18)6-7-12(10)19-14(13)16(22)23-2/h6-8,11,19H,3-5H2,1-2H3,(H,20,21)/t11-/m0/s1