1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)azocane Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H23NO4S/c18-22(19,17-9-4-2-1-3-5-10-17)14-7-8-15-16(13-14)21-12-6-11-20-15/h7-8,13H,1-6,9-12H2