methyl (2S)-3-(1H-indol-3-yl)-2-[2-(3-phenylpropanoyloxy)ethanoylamino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-[2-(3-phenylpropanoyloxy)ethanoylamino]propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[2-(3-phenylpropanoyloxy)acetyl]amino]propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[1-oxo-2-(1-oxo-3-phenylpropoxy)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[2-(3-phenylpropanoyloxy)acetyl]amino]propanoate Traditional Name: (2S)-2-[(2-hydrocinnamoyloxyacetyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)COC(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)COC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-29-23(28)20(13-17-14-24-19-10-6-5-9-18(17)19)25-21(26)15-30-22(27)12-11-16-7-3-2-4-8-16/h2-10,14,20,24H,11-13,15H2,1H3,(H,25,26)/t20-/m0/s1