2-(4-sulfamoylphenoxy)ethyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: 2-(4-sulfamoylphenoxy)ethyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: 2-(4-sulfamoylphenoxy)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid 2-(4-sulfamoylphenoxy)ethyl ester IUPAC Name: 2-(4-sulfamoylphenoxy)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid 2-(4-sulfamoylphenoxy)ethyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCOC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCCOC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O6S/c1-15(2)20(23-19(24)14-16-6-4-3-5-7-16)21(25)29-13-12-28-17-8-10-18(11-9-17)30(22,26)27/h3-11,15,20H,12-14H2,1-2H3,(H,23,24)(H2,22,26,27)/t20-/m0/s1