[5-[[2-(diphenylmethyl)oxy-2-oxidanylidene-ethyl]sulfonylmethyl]-1,2-oxazol-3-yl] benzoate

Systemtic Name: [5-[[2-(diphenylmethyl)oxy-2-oxidanylidene-ethyl]sulfonylmethyl]-1,2-oxazol-3-yl] benzoate Openeye Name: [5-[(2-benzhydryloxy-2-oxo-ethyl)sulfonylmethyl]isoxazol-3-yl] benzoate CAS Name: benzoic acid [5-[[2-(diphenylmethyl)oxy-2-oxoethyl]sulfonylmethyl]-3-isoxazolyl] ester IUPAC Name: [5-[(2-benzhydryloxy-2-oxoethyl)sulfonylmethyl]-1,2-oxazol-3-yl] benzoate Traditional Name: benzoic acid [5-[(2-benzhydryloxy-2-keto-ethyl)sulfonylmethyl]isoxazol-3-yl] ester Formula: C26H21NO7S MolecularWeight: 491.51244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CS(=O)(=O)CC3=CC(=NO3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CS(=O)(=O)CC3=CC(=NO3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO7S/c28-24(33-25(19-10-4-1-5-11-19)20-12-6-2-7-13-20)18-35(30,31)17-22-16-23(27-34-22)32-26(29)21-14-8-3-9-15-21/h1-16,25H,17-18H2