tert-butyl 2-(3-benzamido-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl)-3-methyl-but-3-enoate

Systemtic Name: tert-butyl 2-(3-benzamido-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl)-3-methyl-but-3-enoate Openeye Name: tert-butyl 2-(3-benzamido-2-chlorosulfinyl-4-oxo-azetidin-1-yl)-3-methyl-but-3-enoate CAS Name: 2-(3-benzamido-2-chlorosulfinyl-4-oxo-1-azetidinyl)-3-methyl-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-benzamido-2-chlorosulfinyl-4-oxoazetidin-1-yl)-3-methylbut-3-enoate Traditional Name: 2-(3-benzamido-2-chlorosulfinyl-4-keto-azetidin-1-yl)-3-methyl-but-3-enoic acid tert-butyl ester Formula: C19H23ClN2O5S MolecularWeight: 426.91432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)NC(=O)C2=CC=CC=C2)S(=O)Cl

Isomeric SMILES

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)NC(=O)C2=CC=CC=C2)S(=O)Cl

InChI

InChI=1S/C19H23ClN2O5S/c1-11(2)14(18(25)27-19(3,4)5)22-16(24)13(17(22)28(20)26)21-15(23)12-9-7-6-8-10-12/h6-10,13-14,17H,1H2,2-5H3,(H,21,23)