[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propionic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)C(C)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)[C@H](C)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C21H23NO6S/c1-4-16-5-7-18(8-6-16)20(24)13-28-21(25)14(2)22-29(26,27)19-11-9-17(10-12-19)15(3)23/h5-12,14,22H,4,13H2,1-3H3/t14-/m0/s1