(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2,4,6-trimethylbenzoate

Systemtic Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2,4,6-trimethylbenzoate Openeye Name: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OCC2=NOC(=N2)C3=CSC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OCC2=NOC(=N2)C3=CSC=C3)C

InChI

InChI=1S/C17H16N2O3S/c1-10-6-11(2)15(12(3)7-10)17(20)21-8-14-18-16(22-19-14)13-4-5-23-9-13/h4-7,9H,8H2,1-3H3