5-(dioxidanylamino)-1,1-bis(oxidanylidene)-2-(phenylmethyl)-1,2-thiazepan-4-ol

Systemtic Name: 5-(dioxidanylamino)-1,1-bis(oxidanylidene)-2-(phenylmethyl)-1,2-thiazepan-4-ol Openeye Name: 2-benzyl-5-(hydroperoxyamino)-1,1-dioxo-thiazepan-4-ol CAS Name: 5-(hydroperoxyamino)-1,1-dioxo-2-(phenylmethyl)-4-thiazepanol IUPAC Name: 2-benzyl-5-(hydroperoxyamino)-1,1-dioxothiazepan-4-ol Traditional Name: 2-benzyl-5-(hydroperoxyamino)-1,1-diketo-thiazepan-4-ol Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)N(CC(C1NOO)O)CC2=CC=CC=C2

Isomeric SMILES

C1CS(=O)(=O)N(CC(C1NOO)O)CC2=CC=CC=C2

InChI

InChI=1S/C12H18N2O5S/c15-12-9-14(8-10-4-2-1-3-5-10)20(17,18)7-6-11(12)13-19-16/h1-5,11-13,15-16H,6-9H2