(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic 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 (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C16H12N2O5S/c19-16(12-8-20-10-4-1-2-5-11(10)22-12)21-9-14-17-15(18-23-14)13-6-3-7-24-13/h1-7,12H,8-9H2/t12-/m0/s1