[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-(mesitylsulfonylamino)propionic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)OCC(=O)NC2CCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)OCC(=O)NC2CCCC2)C

InChI

InChI=1S/C19H28N2O5S/c1-13-10-14(2)19(15(3)11-13)27(24,25)20-9-8-18(23)26-12-17(22)21-16-6-4-5-7-16/h10-11,16,20H,4-9,12H2,1-3H3,(H,21,22)