[4-[[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [4-[[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [4-[[2-(4-tert-butylphenyl)-5-oxo-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[2-(4-tert-butylphenyl)-5-oxo-4-oxazolylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[2-(4-tert-butylphenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C22H23NO6S MolecularWeight: 429.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)OS(=O)(=O)C)OC)C(=O)O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)OS(=O)(=O)C)OC)C(=O)O2

InChI

InChI=1S/C22H23NO6S/c1-22(2,3)16-9-7-15(8-10-16)20-23-17(21(24)28-20)12-14-6-11-18(19(13-14)27-4)29-30(5,25)26/h6-13H,1-5H3