(5-ethanoyl-2-ethoxy-phenyl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2S)-3-methyl-2-(phenylcarbamoylamino)butyric acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C(C(C)C)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)[C@H](C(C)C)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O5/c1-5-29-20-12-11-17(16(4)26)13-18(20)14-30-22(27)21(15(2)3)25-23(28)24-19-9-7-6-8-10-19/h6-13,15,21H,5,14H2,1-4H3,(H2,24,25,28)/t21-/m0/s1