2-acetyloxy-2-[2-(bromomethyl)-3-[ethanoyl(thiophen-2-yl)amino]-4-oxidanylidene-azetidin-1-yl]sulfanyl-ethanoic acid

Systemtic Name: 2-acetyloxy-2-[2-(bromomethyl)-3-[ethanoyl(thiophen-2-yl)amino]-4-oxidanylidene-azetidin-1-yl]sulfanyl-ethanoic acid Openeye Name: 2-acetoxy-2-[3-[acetyl(2-thienyl)amino]-2-(bromomethyl)-4-oxo-azetidin-1-yl]sulfanyl-acetic acid CAS Name: 2-acetyloxy-2-[[3-[acetyl(thiophen-2-yl)amino]-2-(bromomethyl)-4-oxo-1-azetidinyl]thio]acetic acid IUPAC Name: 2-acetyloxy-2-[3-[acetyl(thiophen-2-yl)amino]-2-(bromomethyl)-4-oxoazetidin-1-yl]sulfanylacetic acid Traditional Name: 2-acetoxy-2-[[3-[acetyl(2-thienyl)amino]-2-(bromomethyl)-4-keto-azetidin-1-yl]thio]acetic acid Formula: C14H15BrN2O6S2 MolecularWeight: 451.3127

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1C(N(C1=O)SC(C(=O)O)OC(=O)C)CBr)C2=CC=CS2

Isomeric SMILES

CC(=O)N(C1C(N(C1=O)SC(C(=O)O)OC(=O)C)CBr)C2=CC=CS2

InChI

InChI=1S/C14H15BrN2O6S2/c1-7(18)16(10-4-3-5-24-10)11-9(6-15)17(12(11)20)25-14(13(21)22)23-8(2)19/h3-5,9,11,14H,6H2,1-2H3,(H,21,22)