[(1R)-1-cyanoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate Openeye Name: [(1R)-1-cyanoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]acetic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate Traditional Name: 2-(p-phenetylsulfonylamino)acetic acid [(1R)-1-cyanoethyl] ester Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC(C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O[C@H](C)C#N

InChI

InChI=1S/C13H16N2O5S/c1-3-19-11-4-6-12(7-5-11)21(17,18)15-9-13(16)20-10(2)8-14/h4-7,10,15H,3,9H2,1-2H3/t10-/m1/s1