(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC3=NC(=NO3)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC3=NC(=NO3)C4=CC=CS4)O

InChI

InChI=1S/C21H16N2O4S/c24-20(26-14-18-22-19(23-27-18)17-12-7-13-28-17)21(25,15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13,25H,14H2