[4-oxidanylidene-3-(2-oxidanylidene-4,5-diphenyl-1,3-oxazol-3-yl)azetidin-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [4-oxidanylidene-3-(2-oxidanylidene-4,5-diphenyl-1,3-oxazol-3-yl)azetidin-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [4-oxo-3-(2-oxo-4,5-diphenyl-oxazol-3-yl)azetidin-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-oxo-3-(2-oxo-4,5-diphenyl-3-oxazolyl)-2-azetidinyl]methyl ester IUPAC Name: [4-oxo-3-(2-oxo-4,5-diphenyl-1,3-oxazol-3-yl)azetidin-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-keto-3-(2-keto-4,5-diphenyl-4-oxazolin-3-yl)azetidin-2-yl]methyl ester Formula: C26H22N2O6S MolecularWeight: 490.52768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=O)N2)N3C(=C(OC3=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=O)N2)N3C(=C(OC3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O6S/c1-17-12-14-20(15-13-17)35(31,32)33-16-21-23(25(29)27-21)28-22(18-8-4-2-5-9-18)24(34-26(28)30)19-10-6-3-7-11-19/h2-15,21,23H,16H2,1H3,(H,27,29)