(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(propan-2-yloxymethyl)benzoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(propan-2-yloxymethyl)benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-(isopropoxymethyl)benzoate CAS Name: 4-(propan-2-yloxymethyl)benzoic 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 4-(propan-2-yloxymethyl)benzoate Traditional Name: 4-(isopropoxymethyl)benzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CC(C)OCC1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C18H18N2O4S/c1-12(2)22-10-13-5-7-14(8-6-13)18(21)23-11-16-19-17(20-24-16)15-4-3-9-25-15/h3-9,12H,10-11H2,1-2H3