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

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propionic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C18H24N2O6S MolecularWeight: 396.45796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1CCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1CCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C18H24N2O6S/c1-12(18(23)26-11-17(22)19-15-5-3-4-6-15)20-27(24,25)16-9-7-14(8-10-16)13(2)21/h7-10,12,15,20H,3-6,11H2,1-2H3,(H,19,22)/t12-/m0/s1