(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)OC(C2=CC=CC=C2)C(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N[C@@H](C)C(=O)OC(C2=CC=CC=C2)C(=O)N)C)C

InChI

InChI=1S/C21H26N2O5S/c1-12-11-13(2)15(4)19(14(12)3)29(26,27)23-16(5)21(25)28-18(20(22)24)17-9-7-6-8-10-17/h6-11,16,18,23H,1-5H3,(H2,22,24)/t16-,18?/m0/s1