11-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]undecanoic acid

Systemtic Name: 11-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]undecanoic acid Openeye Name: 11-(1-benzylsulfonylpyrrolidin-2-yl)undecanoic acid CAS Name: 11-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]undecanoic acid IUPAC Name: 11-(1-benzylsulfonylpyrrolidin-2-yl)undecanoic acid Traditional Name: 11-(1-benzylsulfonylpyrrolidin-2-yl)undecanoic acid Formula: C22H35NO4S MolecularWeight: 409.5826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)CCCCCCCCCCC(=O)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C22H35NO4S/c24-22(25)17-11-6-4-2-1-3-5-10-15-21-16-12-18-23(21)28(26,27)19-20-13-8-7-9-14-20/h7-9,13-14,21H,1-6,10-12,15-19H2,(H,24,25)