(3R)-3-[(5-bromanylfuran-2-yl)carbonylamino]-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-[(5-bromanylfuran-2-yl)carbonylamino]-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-[(5-bromofuran-2-carbonyl)amino]-4-(trimethylammonio)butanoate CAS Name: (3R)-3-[[(5-bromo-2-furanyl)-oxomethyl]amino]-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-[(5-bromofuran-2-carbonyl)amino]-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-[(5-bromo-2-furoyl)amino]-4-(trimethylammonio)butyrate Formula: C12H17BrN2O4 MolecularWeight: 333.17838

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])NC(=O)C1=CC=C(O1)Br

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)[O-])NC(=O)C1=CC=C(O1)Br

InChI

InChI=1S/C12H17BrN2O4/c1-15(2,3)7-8(6-11(16)17)14-12(18)9-4-5-10(13)19-9/h4-5,8H,6-7H2,1-3H3,(H-,14,16,17,18)/t8-/m1/s1