[1-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-azetidin-3-yl]-2-phenyl-ethyl] benzoate

Systemtic Name: [1-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-azetidin-3-yl]-2-phenyl-ethyl] benzoate Openeye Name: [1-[2-oxo-1-(p-tolylsulfonyl)azetidin-3-yl]-2-phenyl-ethyl] benzoate CAS Name: benzoic acid [1-[1-(4-methylphenyl)sulfonyl-2-oxo-3-azetidinyl]-2-phenylethyl] ester IUPAC Name: [1-[1-(4-methylphenyl)sulfonyl-2-oxoazetidin-3-yl]-2-phenylethyl] benzoate Traditional Name: benzoic acid [1-(2-keto-1-tosyl-azetidin-3-yl)-2-phenyl-ethyl] ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C2=O)C(CC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C2=O)C(CC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H23NO5S/c1-18-12-14-21(15-13-18)32(29,30)26-17-22(24(26)27)23(16-19-8-4-2-5-9-19)31-25(28)20-10-6-3-7-11-20/h2-15,22-23H,16-17H2,1H3