6-[4-methyl-2-(naphthalen-2-ylsulfonylamino)piperidin-1-yl]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[4-methyl-2-(naphthalen-2-ylsulfonylamino)piperidin-1-yl]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[4-methyl-2-(2-naphthylsulfonylamino)-1-piperidyl]-6-oxo-hexanoic acid CAS Name: 6-[4-methyl-2-(2-naphthalenylsulfonylamino)-1-piperidinyl]-6-oxohexanoic acid IUPAC Name: 6-[4-methyl-2-(naphthalen-2-ylsulfonylamino)piperidin-1-yl]-6-oxohexanoic acid Traditional Name: 6-keto-6-[4-methyl-2-(2-naphthylsulfonylamino)piperidino]hexanoic acid Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CCCCC(=O)O

Isomeric SMILES

CC1CCN(C(C1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)CCCCC(=O)O

InChI

InChI=1S/C22H28N2O5S/c1-16-12-13-24(21(25)8-4-5-9-22(26)27)20(14-16)23-30(28,29)19-11-10-17-6-2-3-7-18(17)15-19/h2-3,6-7,10-11,15-16,20,23H,4-5,8-9,12-14H2,1H3,(H,26,27)