tert-butyl 2-[2-chloranyl-4-oxidanylidene-3-(propanoylamino)azetidin-1-yl]-3-(chloromethyl)but-3-enoate

Systemtic Name: tert-butyl 2-[2-chloranyl-4-oxidanylidene-3-(propanoylamino)azetidin-1-yl]-3-(chloromethyl)but-3-enoate Openeye Name: tert-butyl 3-(chloromethyl)-2-[2-chloro-4-oxo-3-(propanoylamino)azetidin-1-yl]but-3-enoate CAS Name: 3-(chloromethyl)-2-[2-chloro-4-oxo-3-(1-oxopropylamino)-1-azetidinyl]-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(chloromethyl)-2-[2-chloro-4-oxo-3-(propanoylamino)azetidin-1-yl]but-3-enoate Traditional Name: 2-(2-chloro-4-keto-3-propionamido-azetidin-1-yl)-3-(chloromethyl)but-3-enoic acid tert-butyl ester Formula: C15H22Cl2N2O4 MolecularWeight: 365.25218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1C(N(C1=O)C(C(=C)CCl)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCC(=O)NC1C(N(C1=O)C(C(=C)CCl)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C15H22Cl2N2O4/c1-6-9(20)18-10-12(17)19(13(10)21)11(8(2)7-16)14(22)23-15(3,4)5/h10-12H,2,6-7H2,1,3-5H3,(H,18,20)