(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 1-(4-chlorophenyl)sulfonylcyclobutanecarboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-1-cyclobutanecarboxylic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1-(4-chlorophenyl)sulfonylcyclobutane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylcyclobutanecarboxylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C19H16ClNO5S2 MolecularWeight: 437.91704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C(=O)OCC2=NOC(=C2)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(C1)(C(=O)OCC2=NOC(=C2)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H16ClNO5S2/c20-13-4-6-15(7-5-13)28(23,24)19(8-2-9-19)18(22)25-12-14-11-16(26-21-14)17-3-1-10-27-17/h1,3-7,10-11H,2,8-9,12H2