1-(azepan-1-yl)-2-(phenylsulfonyl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(phenylsulfonyl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(benzenesulfonyl)ethanone CAS Name: 1-(1-azepanyl)-2-(benzenesulfonyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(benzenesulfonyl)ethanone Traditional Name: 1-(azepan-1-yl)-2-besyl-ethanone Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=O)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H19NO3S/c16-14(15-10-6-1-2-7-11-15)12-19(17,18)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2