[(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: [(2S)-1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: [(1S)-2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethoxyphenyl)-1-oxopropan-2-yl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2S)-3-methyl-2-(phenylcarbamoylamino)butyric acid [(1S)-2-keto-1-methyl-2-p-phenetyl-ethyl] ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O5/c1-5-29-19-13-11-17(12-14-19)21(26)16(4)30-22(27)20(15(2)3)25-23(28)24-18-9-7-6-8-10-18/h6-16,20H,5H2,1-4H3,(H2,24,25,28)/t16-,20-/m0/s1