2-[1-butylsulfonyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-2-yl]ethanoic acid

Systemtic Name: 2-[1-butylsulfonyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-2-yl]ethanoic acid Openeye Name: 2-[4-(2-tert-butoxy-2-oxo-ethyl)-1-butylsulfonyl-3-oxo-piperazin-2-yl]acetic acid CAS Name: 2-[1-butylsulfonyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-oxo-2-piperazinyl]acetic acid IUPAC Name: 2-[1-butylsulfonyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-oxopiperazin-2-yl]acetic acid Traditional Name: 2-[4-(2-tert-butoxy-2-keto-ethyl)-1-butylsulfonyl-3-keto-piperazin-2-yl]acetic acid Formula: C16H28N2O7S MolecularWeight: 392.46772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(C(=O)C1CC(=O)O)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(C(=O)C1CC(=O)O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C16H28N2O7S/c1-5-6-9-26(23,24)18-8-7-17(11-14(21)25-16(2,3)4)15(22)12(18)10-13(19)20/h12H,5-11H2,1-4H3,(H,19,20)