(2S)-2-azanyl-3-(6-ethynyl-1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(6-ethynyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(6-ethynyl-1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-amino-3-(6-ethynyl-1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-amino-3-(6-ethynyl-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(6-ethynyl-1H-indol-3-yl)propionic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)C(=CN2)CC(C(=O)O)N

Isomeric SMILES

C#CC1=CC2=C(C=C1)C(=CN2)C[C@@H](C(=O)O)N

InChI

InChI=1S/C13H12N2O2/c1-2-8-3-4-10-9(6-11(14)13(16)17)7-15-12(10)5-8/h1,3-5,7,11,15H,6,14H2,(H,16,17)/t11-/m0/s1