(3S)-5-bromanyl-3-[[(4S)-2-oxidanylidene-4-propan-2-yl-1,3-oxazolidin-3-yl]carbonyl]hex-5-enoic acid

Systemtic Name: (3S)-5-bromanyl-3-[[(4S)-2-oxidanylidene-4-propan-2-yl-1,3-oxazolidin-3-yl]carbonyl]hex-5-enoic acid Openeye Name: (3S)-5-bromo-3-[(4S)-4-isopropyl-2-oxo-oxazolidine-3-carbonyl]hex-5-enoic acid CAS Name: (3S)-5-bromo-3-[oxo-[(4S)-2-oxo-4-propan-2-yl-3-oxazolidinyl]methyl]-5-hexenoic acid IUPAC Name: (3S)-5-bromo-3-[(4S)-2-oxo-4-propan-2-yl-1,3-oxazolidine-3-carbonyl]hex-5-enoic acid Traditional Name: (3S)-5-bromo-3-[(4S)-4-isopropyl-2-keto-oxazolidine-3-carbonyl]hex-5-enoic acid Formula: C13H18BrNO5 MolecularWeight: 348.18972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1COC(=O)N1C(=O)C(CC(=C)Br)CC(=O)O

Isomeric SMILES

CC(C)[C@H]1COC(=O)N1C(=O)[C@H](CC(=C)Br)CC(=O)O

InChI

InChI=1S/C13H18BrNO5/c1-7(2)10-6-20-13(19)15(10)12(18)9(4-8(3)14)5-11(16)17/h7,9-10H,3-6H2,1-2H3,(H,16,17)/t9-,10-/m1/s1