3-(1,3-benzodioxol-5-ylmethoxy)propanethioamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethoxy)propanethioamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethoxy)propanethioamide CAS Name: 3-(1,3-benzodioxol-5-ylmethoxy)propanethioamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethoxy)propanethioamide Traditional Name: 3-piperonyloxythiopropionamide Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COCCC(=S)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COCCC(=S)N

InChI

InChI=1S/C11H13NO3S/c12-11(16)3-4-13-6-8-1-2-9-10(5-8)15-7-14-9/h1-2,5H,3-4,6-7H2,(H2,12,16)