methyl 2-(3-azido-2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-phenyl-ethanoate

Systemtic Name: methyl 2-(3-azido-2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-phenyl-ethanoate Openeye Name: methyl 2-(3-azido-2-methylsulfanyl-4-oxo-azetidin-1-yl)-2-phenyl-acetate CAS Name: 2-[3-azido-2-(methylthio)-4-oxo-1-azetidinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-(3-azido-2-methylsulfanyl-4-oxoazetidin-1-yl)-2-phenylacetate Traditional Name: 2-[3-azido-2-keto-4-(methylthio)azetidin-1-yl]-2-phenyl-acetic acid methyl ester Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2C(C(C2=O)N=[N+]=[N-])SC

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2C(C(C2=O)N=[N+]=[N-])SC

InChI

InChI=1S/C13H14N4O3S/c1-20-13(19)10(8-6-4-3-5-7-8)17-11(18)9(15-16-14)12(17)21-2/h3-7,9-10,12H,1-2H3