2-(4-phenoxyphenyl)sulfonyl-1-prop-2-ynyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 2-(4-phenoxyphenyl)sulfonyl-1-prop-2-ynyl-pyrrolidine-2-carboxylic acid Openeye Name: 2-(4-phenoxyphenyl)sulfonyl-1-prop-2-ynyl-pyrrolidine-2-carboxylic acid CAS Name: 2-(4-phenoxyphenyl)sulfonyl-1-prop-2-ynyl-2-pyrrolidinecarboxylic acid IUPAC Name: 2-(4-phenoxyphenyl)sulfonyl-1-prop-2-ynylpyrrolidine-2-carboxylic acid Traditional Name: 2-(4-phenoxyphenyl)sulfonyl-1-propargyl-proline Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C#CCN1CCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H19NO5S/c1-2-14-21-15-6-13-20(21,19(22)23)27(24,25)18-11-9-17(10-12-18)26-16-7-4-3-5-8-16/h1,3-5,7-12H,6,13-15H2,(H,22,23)