(2S)-3-acetamido-2-(1H-indol-3-yl)propanoate

Systemtic Name: (2S)-3-acetamido-2-(1H-indol-3-yl)propanoate Openeye Name: (2S)-3-acetamido-2-(1H-indol-3-yl)propanoate CAS Name: (2S)-3-acetamido-2-(1H-indol-3-yl)propanoate IUPAC Name: (2S)-3-acetamido-2-(1H-indol-3-yl)propanoate Traditional Name: (2S)-3-acetamido-2-(1H-indol-3-yl)propionate Formula: C13H13N2O3- MolecularWeight: 245.25392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(C1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CC(=O)NC[C@H](C1=CNC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C13H14N2O3/c1-8(16)14-7-11(13(17)18)10-6-15-12-5-3-2-4-9(10)12/h2-6,11,15H,7H2,1H3,(H,14,16)(H,17,18)/p-1/t11-/m1/s1