methyl 3-[1-(3-sulfamoylphenyl)ethylamino]propanoate

Systemtic Name: methyl 3-[1-(3-sulfamoylphenyl)ethylamino]propanoate Openeye Name: methyl 3-[1-(3-sulfamoylphenyl)ethylamino]propanoate CAS Name: 3-[1-(3-sulfamoylphenyl)ethylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-sulfamoylphenyl)ethylamino]propanoate Traditional Name: 3-[1-(3-sulfamoylphenyl)ethylamino]propionic acid methyl ester Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)S(=O)(=O)N)NCCC(=O)OC

Isomeric SMILES

CC(C1=CC(=CC=C1)S(=O)(=O)N)NCCC(=O)OC

InChI

InChI=1S/C12H18N2O4S/c1-9(14-7-6-12(15)18-2)10-4-3-5-11(8-10)19(13,16)17/h3-5,8-9,14H,6-7H2,1-2H3,(H2,13,16,17)