[(1R)-1-cyanoethyl] 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoate

Systemtic Name: [(1R)-1-cyanoethyl] 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanoate Openeye Name: [(1R)-1-cyanoethyl] 4-[(4-acetylphenyl)sulfonyl-methyl-amino]butanoate CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]butanoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 4-[(4-acetylphenyl)sulfonyl-methylamino]butanoate Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]butyric acid [(1R)-1-cyanoethyl] ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C

Isomeric SMILES

C[C@H](C#N)OC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C16H20N2O5S/c1-12(11-17)23-16(20)5-4-10-18(3)24(21,22)15-8-6-14(7-9-15)13(2)19/h6-9,12H,4-5,10H2,1-3H3/t12-/m1/s1