N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-esyl-isonipecotamide Formula: C16H21BrN2O5S MolecularWeight: 433.31734

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C16H21BrN2O5S/c1-2-25(21,22)19-5-3-11(4-6-19)16(20)18-13-10-15-14(9-12(13)17)23-7-8-24-15/h9-11H,2-8H2,1H3,(H,18,20)