(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propanoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propionic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C19H22N2O5S MolecularWeight: 390.45338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OC(C2=CC=CC=C2)C(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OC(C2=CC=CC=C2)C(=O)N)C

InChI

InChI=1S/C19H22N2O5S/c1-13-8-9-16(12-14(13)2)27(24,25)21-11-10-17(22)26-18(19(20)23)15-6-4-3-5-7-15/h3-9,12,18,21H,10-11H2,1-2H3,(H2,20,23)