N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]acetamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H27N3O5S/c1-2-3-6-19-18(22)14-20-7-9-21(10-8-20)27(23,24)15-4-5-16-17(13-15)26-12-11-25-16/h4-5,13H,2-3,6-12,14H2,1H3,(H,19,22)