[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 3-[isopropyl(methyl)sulfamoyl]benzoate CAS Name: 3-[methyl(propan-2-yl)sulfamoyl]benzoic acid [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl] 3-[methyl(propan-2-yl)sulfamoyl]benzoate Traditional Name: 3-[isopropyl(methyl)sulfamoyl]benzoic acid [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)OC(C)C(=O)N2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C(C)C

InChI

InChI=1S/C20H30N2O5S/c1-15(2)21(4)28(25,26)18-11-9-10-17(14-18)20(24)27-16(3)19(23)22-12-7-5-6-8-13-22/h9-11,14-16H,5-8,12-13H2,1-4H3/t16-/m1/s1