(2-oxidanylidene-1,3-benzoxathiol-6-yl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,3-benzoxathiol-6-yl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: (2-oxo-1,3-benzoxathiol-6-yl) 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid (2-oxo-1,3-benzoxathiol-6-yl) ester IUPAC Name: (2-oxo-1,3-benzoxathiol-6-yl) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid (2-keto-1,3-benzoxathiol-6-yl) ester Formula: C18H11NO5S MolecularWeight: 353.34864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)SC(=O)O4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)SC(=O)O4

InChI

InChI=1S/C18H11NO5S/c1-10-15(16(19-24-10)11-5-3-2-4-6-11)17(20)22-12-7-8-14-13(9-12)23-18(21)25-14/h2-9H,1H3