1-(4-methylphenyl)sulfonyl-3-phenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-phenyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 3-phenyl-1-tosyl-proline Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO4S/c1-13-7-9-15(10-8-13)24(22,23)19-12-11-16(17(19)18(20)21)14-5-3-2-4-6-14/h2-10,16-17H,11-12H2,1H3,(H,20,21)