(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C17H15NO5S2 MolecularWeight: 377.4347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

InChI=1S/C17H15NO5S2/c1-11-5-6-13(25(2,20)21)9-14(11)17(19)22-10-12-8-15(23-18-12)16-4-3-7-24-16/h3-9H,10H2,1-2H3