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

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C18H14ClNO5S MolecularWeight: 391.82546

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H14ClNO5S/c1-26(22,23)14-7-8-16(19)15(10-14)18(21)24-11-13-9-17(25-20-13)12-5-3-2-4-6-12/h2-10H,11H2,1H3