methyl (2R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]butanoate

Systemtic Name: methyl (2R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]butanoate Openeye Name: methyl (2R)-3-methyl-2-[[1-(p-tolylsulfonyl)piperidine-2-carbonyl]amino]butanoate CAS Name: (2R)-3-methyl-2-[[[1-(4-methylphenyl)sulfonyl-2-piperidinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidine-2-carbonyl]amino]butanoate Traditional Name: (2R)-3-methyl-2-[(1-tosylpipecoloyl)amino]butyric acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)N[C@H](C(C)C)C(=O)OC

InChI

InChI=1S/C19H28N2O5S/c1-13(2)17(19(23)26-4)20-18(22)16-7-5-6-12-21(16)27(24,25)15-10-8-14(3)9-11-15/h8-11,13,16-17H,5-7,12H2,1-4H3,(H,20,22)/t16?,17-/m1/s1