2-(phenylmethyl)-3-pyrrolidin-1-ylsulfonyl-propanoic acid

Systemtic Name: 2-(phenylmethyl)-3-pyrrolidin-1-ylsulfonyl-propanoic acid Openeye Name: 2-benzyl-3-pyrrolidin-1-ylsulfonyl-propanoic acid CAS Name: 2-(phenylmethyl)-3-(1-pyrrolidinylsulfonyl)propanoic acid IUPAC Name: 2-benzyl-3-pyrrolidin-1-ylsulfonylpropanoic acid Traditional Name: 2-benzyl-3-pyrrolidinosulfonyl-propionic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H19NO4S/c16-14(17)13(10-12-6-2-1-3-7-12)11-20(18,19)15-8-4-5-9-15/h1-3,6-7,13H,4-5,8-11H2,(H,16,17)