[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-(4-propan-2-ylsulfonylphenyl)ethanoate

Systemtic Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-(4-propan-2-ylsulfonylphenyl)ethanoate Openeye Name: [5-(p-tolyl)isoxazol-3-yl]methyl 2-(4-isopropylsulfonylphenyl)acetate CAS Name: 2-(4-propan-2-ylsulfonylphenyl)acetic acid [5-(4-methylphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-(4-propan-2-ylsulfonylphenyl)acetate Traditional Name: 2-(4-isopropylsulfonylphenyl)acetic acid [5-(p-tolyl)isoxazol-3-yl]methyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CC3=CC=C(C=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H23NO5S/c1-15(2)29(25,26)20-10-6-17(7-11-20)12-22(24)27-14-19-13-21(28-23-19)18-8-4-16(3)5-9-18/h4-11,13,15H,12,14H2,1-3H3