[(1R)-1-cyanoethyl] 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate Openeye Name: [(1R)-1-cyanoethyl] 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoate Traditional Name: 2-methyl-5-[methyl(p-phenetyl)sulfamoyl]benzoic acid [(1R)-1-cyanoethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OC(C)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O[C@H](C)C#N

InChI

InChI=1S/C20H22N2O5S/c1-5-26-17-9-7-16(8-10-17)22(4)28(24,25)18-11-6-14(2)19(12-18)20(23)27-15(3)13-21/h6-12,15H,5H2,1-4H3/t15-/m1/s1