[(1R)-1-cyanoethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: [(1R)-1-cyanoethyl] 2-[2-furylmethyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[2-furanylmethyl-(4-methylphenyl)sulfonylamino]acetic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[2-furfuryl(tosyl)amino]acetic acid [(1R)-1-cyanoethyl] ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)OC(C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)O[C@H](C)C#N

InChI

InChI=1S/C17H18N2O5S/c1-13-5-7-16(8-6-13)25(21,22)19(11-15-4-3-9-23-15)12-17(20)24-14(2)10-18/h3-9,14H,11-12H2,1-2H3/t14-/m1/s1