1-(3-methoxycarbonylphenyl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-methoxycarbonylphenyl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(3-methoxycarbonylphenyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-(3-methoxycarbonylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-methoxycarbonylphenyl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(3-carbomethoxyphenyl)sulfonylproline Formula: C13H15NO6S MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2C(=O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C13H15NO6S/c1-20-13(17)9-4-2-5-10(8-9)21(18,19)14-7-3-6-11(14)12(15)16/h2,4-5,8,11H,3,6-7H2,1H3,(H,15,16)