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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Openeye Name: (2-amino-2-oxo-ethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propanoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propionic acid (2-amino-2-keto-ethyl) ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)N)C

InChI

InChI=1S/C13H18N2O5S/c1-9-3-4-11(7-10(9)2)21(18,19)15-6-5-13(17)20-8-12(14)16/h3-4,7,15H,5-6,8H2,1-2H3,(H2,14,16)