methyl 3-azanyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate hydrochloride

Systemtic Name: methyl 3-azanyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate hydrochloride Openeye Name: methyl 3-amino-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate hydrochloride CAS Name: 3-amino-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 3-amino-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate hydrochloride Traditional Name: 3-amino-2-(mesitylsulfonylamino)propionic acid methyl ester hydrochloride Formula: C13H21ClN2O4S MolecularWeight: 336.83484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(CN)C(=O)OC)C.Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(CN)C(=O)OC)C.Cl

InChI

InChI=1S/C13H20N2O4S.ClH/c1-8-5-9(2)12(10(3)6-8)20(17,18)15-11(7-14)13(16)19-4;/h5-6,11,15H,7,14H2,1-4H3;1H