methyl 3-(cyclohexylamino)-2-(methylsulfonyloxymethyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: methyl 3-(cyclohexylamino)-2-(methylsulfonyloxymethyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: methyl 3-(cyclohexylamino)-2-(methylsulfonyloxymethyl)-3-oxo-2-phenyl-propanoate CAS Name: 3-(cyclohexylamino)-2-(methylsulfonyloxymethyl)-3-oxo-2-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-(cyclohexylamino)-2-(methylsulfonyloxymethyl)-3-oxo-2-phenylpropanoate Traditional Name: 3-(cyclohexylamino)-3-keto-2-(methylsulfonyloxymethyl)-2-phenyl-propionic acid methyl ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(COS(=O)(=O)C)(C1=CC=CC=C1)C(=O)NC2CCCCC2

Isomeric SMILES

COC(=O)C(COS(=O)(=O)C)(C1=CC=CC=C1)C(=O)NC2CCCCC2

InChI

InChI=1S/C18H25NO6S/c1-24-17(21)18(13-25-26(2,22)23,14-9-5-3-6-10-14)16(20)19-15-11-7-4-8-12-15/h3,5-6,9-10,15H,4,7-8,11-13H2,1-2H3,(H,19,20)