[2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2R)-1-(p-tolylsulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2R)-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: (2R)-1-tosylpipecolinic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCC(=O)NC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC3CC3

InChI

InChI=1S/C18H24N2O5S/c1-13-5-9-15(10-6-13)26(23,24)20-11-3-2-4-16(20)18(22)25-12-17(21)19-14-7-8-14/h5-6,9-10,14,16H,2-4,7-8,11-12H2,1H3,(H,19,21)/t16-/m1/s1