methyl 3-[(1-piperidin-1-ylcyclohexyl)methylsulfamoyl]benzoate

Systemtic Name: methyl 3-[(1-piperidin-1-ylcyclohexyl)methylsulfamoyl]benzoate Openeye Name: methyl 3-[[1-(1-piperidyl)cyclohexyl]methylsulfamoyl]benzoate CAS Name: 3-[[1-(1-piperidinyl)cyclohexyl]methylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-piperidin-1-ylcyclohexyl)methylsulfamoyl]benzoate Traditional Name: 3-[(1-piperidinocyclohexyl)methylsulfamoyl]benzoic acid methyl ester Formula: C20H30N2O4S MolecularWeight: 394.5282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2(CCCCC2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2(CCCCC2)N3CCCCC3

InChI

InChI=1S/C20H30N2O4S/c1-26-19(23)17-9-8-10-18(15-17)27(24,25)21-16-20(11-4-2-5-12-20)22-13-6-3-7-14-22/h8-10,15,21H,2-7,11-14,16H2,1H3