methyl 3-[[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[(2S)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(2S)-4-methyl-2-morpholin-4-ium-4-ylpentyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C16H27N2O5S2+ MolecularWeight: 391.52598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNS(=O)(=O)C1=C(SC=C1)C(=O)OC)[NH+]2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](CNS(=O)(=O)C1=C(SC=C1)C(=O)OC)[NH+]2CCOCC2

InChI

InChI=1S/C16H26N2O5S2/c1-12(2)10-13(18-5-7-23-8-6-18)11-17-25(20,21)14-4-9-24-15(14)16(19)22-3/h4,9,12-13,17H,5-8,10-11H2,1-3H3/p+1/t13-/m0/s1