methyl 3-cyclopropyl-3-oxidanylidene-2-[2-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]sulfanyl-propanoate

Systemtic Name: methyl 3-cyclopropyl-3-oxidanylidene-2-[2-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]sulfanyl-propanoate Openeye Name: methyl 3-cyclopropyl-3-oxo-2-[2-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]sulfanyl-propanoate CAS Name: 3-cyclopropyl-3-oxo-2-[[2-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-cyclopropyl-3-oxo-2-[2-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]sulfanylpropanoate Traditional Name: 3-cyclopropyl-3-keto-2-[[2-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]thio]propionic acid methyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=O)C1CC1)SN2CC(C2=O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(C(=O)C1CC1)SN2CC(C2=O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O6S/c1-25-18(24)16(15(22)11-7-8-11)27-20-9-13(17(20)23)19-14(21)10-26-12-5-3-2-4-6-12/h2-6,11,13,16H,7-10H2,1H3,(H,19,21)