[(1R)-1-cyanoethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: [(1R)-1-cyanoethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [(1R)-1-cyanoethyl] ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)COCC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[C@H](C#N)OC(=O)COCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H12N2O3S/c1-9(6-14)18-13(16)8-17-7-12-15-10-4-2-3-5-11(10)19-12/h2-5,9H,7-8H2,1H3/t9-/m1/s1