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

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propionic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C16H20N2O6S MolecularWeight: 368.4048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C16H20N2O6S/c1-10(16(21)24-9-15(20)17-13-5-6-13)18-25(22,23)14-7-3-12(4-8-14)11(2)19/h3-4,7-8,10,13,18H,5-6,9H2,1-2H3,(H,17,20)/t10-/m0/s1