1-[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonyl-1,4-diazepan-1-yl)ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-(4-benzylsulfonyl-1,4-diazepan-1-yl)ethanone Traditional Name: 1-(4-benzylsulfonyl-1,4-diazepan-1-yl)ethanone Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)N1CCCN(CC1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H20N2O3S/c1-13(17)15-8-5-9-16(11-10-15)20(18,19)12-14-6-3-2-4-7-14/h2-4,6-7H,5,8-12H2,1H3