(diphenylmethyl) 3-methyl-2-[2-oxidanylidene-4-(phenylmethyl)sulfonyl-azetidin-1-yl]but-2-enoate

Systemtic Name: (diphenylmethyl) 3-methyl-2-[2-oxidanylidene-4-(phenylmethyl)sulfonyl-azetidin-1-yl]but-2-enoate Openeye Name: benzhydryl 2-(2-benzylsulfonyl-4-oxo-azetidin-1-yl)-3-methyl-but-2-enoate CAS Name: 3-methyl-2-[2-oxo-4-(phenylmethyl)sulfonyl-1-azetidinyl]-2-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-(2-benzylsulfonyl-4-oxoazetidin-1-yl)-3-methylbut-2-enoate Traditional Name: 2-(2-benzylsulfonyl-4-keto-azetidin-1-yl)-3-methyl-but-2-enoic acid benzhydryl ester Formula: C28H27NO5S MolecularWeight: 489.58268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(CC3=O)S(=O)(=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC(=C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(CC3=O)S(=O)(=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H27NO5S/c1-20(2)26(29-24(30)18-25(29)35(32,33)19-21-12-6-3-7-13-21)28(31)34-27(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,25,27H,18-19H2,1-2H3