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

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] (2S)-2-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-acetylphenyl)sulfonylamino]propionic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C19H26N2O6S/c1-13(19(24)27-12-18(23)20-16-6-4-3-5-7-16)21-28(25,26)17-10-8-15(9-11-17)14(2)22/h8-11,13,16,21H,3-7,12H2,1-2H3,(H,20,23)/t13-/m0/s1