2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)pyrrolidin-2-yl]ethanoic acid

Systemtic Name: 2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)pyrrolidin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)pyrrolidin-2-yl]acetic acid CAS Name: 2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)-2-pyrrolidinyl]acetic acid IUPAC Name: 2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)pyrrolidin-2-yl]acetic acid Traditional Name: 2-[(2R)-1-(1,3-benzodioxol-5-ylsulfonyl)pyrrolidin-2-yl]acetic acid Formula: C13H15NO6S MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3)CC(=O)O

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCO3)CC(=O)O

InChI

InChI=1S/C13H15NO6S/c15-13(16)6-9-2-1-5-14(9)21(17,18)10-3-4-11-12(7-10)20-8-19-11/h3-4,7,9H,1-2,5-6,8H2,(H,15,16)/t9-/m1/s1