(phenylmethyl) 2-[3-[2-(3-bromanylphenoxy)ethanoylamino]-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (phenylmethyl) 2-[3-[2-(3-bromanylphenoxy)ethanoylamino]-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: benzyl 2-[3-[[2-(3-bromophenoxy)acetyl]amino]-2-chlorosulfinyl-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[3-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-2-chlorosulfinyl-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-[[2-(3-bromophenoxy)acetyl]amino]-2-chlorosulfinyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[3-[[2-(3-bromophenoxy)acetyl]amino]-2-chlorosulfinyl-4-keto-azetidin-1-yl]-3-methyl-but-3-enoic acid benzyl ester Formula: C23H22BrClN2O6S MolecularWeight: 569.85258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)NC(=O)COC3=CC(=CC=C3)Br)S(=O)Cl

Isomeric SMILES

CC(=C)C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)NC(=O)COC3=CC(=CC=C3)Br)S(=O)Cl

InChI

InChI=1S/C23H22BrClN2O6S/c1-14(2)20(23(30)33-12-15-7-4-3-5-8-15)27-21(29)19(22(27)34(25)31)26-18(28)13-32-17-10-6-9-16(24)11-17/h3-11,19-20,22H,1,12-13H2,2H3,(H,26,28)