3-methyl-2-(phenethylcarbamoyl)-3-(4-phenylmethoxyphenyl)-2-(propanoylamino)butanoic acid

Systemtic Name: 3-methyl-2-(phenethylcarbamoyl)-3-(4-phenylmethoxyphenyl)-2-(propanoylamino)butanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-3-methyl-2-(phenethylcarbamoyl)-2-(propanoylamino)butanoic acid CAS Name: 3-methyl-2-[oxo-(phenethylamino)methyl]-2-(1-oxopropylamino)-3-(4-phenylmethoxyphenyl)butanoic acid IUPAC Name: 3-methyl-2-(phenethylcarbamoyl)-3-(4-phenylmethoxyphenyl)-2-(propanoylamino)butanoic acid Traditional Name: 3-(4-benzoxyphenyl)-3-methyl-2-(phenethylcarbamoyl)-2-propionamido-butyric acid Formula: C30H34N2O5 MolecularWeight: 502.60136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C(=O)NCCC1=CC=CC=C1)(C(=O)O)C(C)(C)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC(C(=O)NCCC1=CC=CC=C1)(C(=O)O)C(C)(C)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C30H34N2O5/c1-4-26(33)32-30(28(35)36,27(34)31-20-19-22-11-7-5-8-12-22)29(2,3)24-15-17-25(18-16-24)37-21-23-13-9-6-10-14-23/h5-18H,4,19-21H2,1-3H3,(H,31,34)(H,32,33)(H,35,36)