2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]pentanedioic acid Openeye Name: 2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]pentanedioic acid CAS Name: 2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]pentanedioic acid Traditional Name: 2-[(1-tosylprolyl)amino]glutaric acid Formula: C17H22N2O7S MolecularWeight: 398.43078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C17H22N2O7S/c1-11-4-6-12(7-5-11)27(25,26)19-10-2-3-14(19)16(22)18-13(17(23)24)8-9-15(20)21/h4-7,13-14H,2-3,8-10H2,1H3,(H,18,22)(H,20,21)(H,23,24)