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

Systemtic Name: 2-(4-methylphenoxy)ethyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: 2-(4-methylphenoxy)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid 2-(4-methylphenoxy)ethyl ester IUPAC Name: 2-(4-methylphenoxy)ethyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid 2-(4-methylphenoxy)ethyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCOC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)OCCOC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C22H27NO4/c1-16(2)21(23-20(24)15-18-7-5-4-6-8-18)22(25)27-14-13-26-19-11-9-17(3)10-12-19/h4-12,16,21H,13-15H2,1-3H3,(H,23,24)/t21-/m0/s1