methyl 4-[(2-morpholin-4-yl-1-phenyl-ethyl)sulfamoyl]benzoate hydrochloride

Systemtic Name: methyl 4-[(2-morpholin-4-yl-1-phenyl-ethyl)sulfamoyl]benzoate hydrochloride Openeye Name: methyl 4-[(2-morpholino-1-phenyl-ethyl)sulfamoyl]benzoate hydrochloride CAS Name: 4-[[2-(4-morpholinyl)-1-phenylethyl]sulfamoyl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[(2-morpholin-4-yl-1-phenylethyl)sulfamoyl]benzoate hydrochloride Traditional Name: 4-[(2-morpholino-1-phenyl-ethyl)sulfamoyl]benzoic acid methyl ester hydrochloride Formula: C20H25ClN2O5S MolecularWeight: 440.9409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CN2CCOCC2)C3=CC=CC=C3.Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CN2CCOCC2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C20H24N2O5S.ClH/c1-26-20(23)17-7-9-18(10-8-17)28(24,25)21-19(16-5-3-2-4-6-16)15-22-11-13-27-14-12-22;/h2-10,19,21H,11-15H2,1H3;1H