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

Systemtic Name: 4-methyl-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]pentanoic acid Openeye Name: 4-methyl-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[(1-tosylprolyl)amino]valeric acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5S/c1-12(2)11-15(18(22)23)19-17(21)16-5-4-10-20(16)26(24,25)14-8-6-13(3)7-9-14/h6-9,12,15-16H,4-5,10-11H2,1-3H3,(H,19,21)(H,22,23)