(2S)-2-[2-(5-phenylmethoxyindol-1-yl)ethanoylamino]propanoic acid

Systemtic Name: (2S)-2-[2-(5-phenylmethoxyindol-1-yl)ethanoylamino]propanoic acid Openeye Name: (2S)-2-[[2-(5-benzyloxyindol-1-yl)acetyl]amino]propanoic acid CAS Name: (2S)-2-[[1-oxo-2-(5-phenylmethoxy-1-indolyl)ethyl]amino]propanoic acid IUPAC Name: (2S)-2-[[2-(5-phenylmethoxyindol-1-yl)acetyl]amino]propanoic acid Traditional Name: (2S)-2-[[2-(5-benzoxyindol-1-yl)acetyl]amino]propionic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CN1C=CC2=C1C=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)CN1C=CC2=C1C=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-14(20(24)25)21-19(23)12-22-10-9-16-11-17(7-8-18(16)22)26-13-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3,(H,21,23)(H,24,25)/t14-/m0/s1