(2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropyl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropyl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropanecarbonyl)amino]propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[oxo-(2-phenylcyclopropyl)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropanecarbonyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropanecarbonyl)amino]propionic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1C(C1C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O3/c24-20(17-11-16(17)13-6-2-1-3-7-13)23-19(21(25)26)10-14-12-22-18-9-5-4-8-15(14)18/h1-9,12,16-17,19,22H,10-11H2,(H,23,24)(H,25,26)/t16?,17?,19-/m0/s1