methyl 4-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4-(thiophen-2-ylsulfonylamino)piperidin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[4-(2-thienylsulfonylamino)piperidine-1-carbonyl]benzoate CAS Name: 4-[oxo-[4-(thiophen-2-ylsulfonylamino)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(thiophen-2-ylsulfonylamino)piperidine-1-carbonyl]benzoate Traditional Name: 4-[4-(2-thienylsulfonylamino)piperidine-1-carbonyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N2O5S2/c1-25-18(22)14-6-4-13(5-7-14)17(21)20-10-8-15(9-11-20)19-27(23,24)16-3-2-12-26-16/h2-7,12,15,19H,8-11H2,1H3