7-(butylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: 7-(butylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: 7-(butylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: 7-[(butylthio)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: 7-(butylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: [7-[(butylthio)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]amine Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1=CC2=C(C=C1N)OCCO2

Isomeric SMILES

CCCCSCC1=CC2=C(C=C1N)OCCO2

InChI

InChI=1S/C13H19NO2S/c1-2-3-6-17-9-10-7-12-13(8-11(10)14)16-5-4-15-12/h7-8H,2-6,9,14H2,1H3