3-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfonylpropanoate

Systemtic Name: 3-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfonylpropanoate Openeye Name: 3-[(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]sulfonylpropanoate CAS Name: 3-[(2R)-1-(1-azepanyl)-1-oxopropan-2-yl]sulfonylpropanoate IUPAC Name: 3-[(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl]sulfonylpropanoate Traditional Name: 3-[(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]sulfonylpropionate Formula: C12H20NO5S- MolecularWeight: 290.3559

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)S(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)S(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H21NO5S/c1-10(19(17,18)9-6-11(14)15)12(16)13-7-4-2-3-5-8-13/h10H,2-9H2,1H3,(H,14,15)/p-1/t10-/m1/s1