(2S)-2-cyano-3-(1H-indol-3-yl)-2-methyl-propanoic acid

Systemtic Name: (2S)-2-cyano-3-(1H-indol-3-yl)-2-methyl-propanoic acid Openeye Name: (2S)-2-cyano-3-(1H-indol-3-yl)-2-methyl-propanoic acid CAS Name: (2S)-2-cyano-3-(1H-indol-3-yl)-2-methylpropanoic acid IUPAC Name: (2S)-2-cyano-3-(1H-indol-3-yl)-2-methylpropanoic acid Traditional Name: (2S)-2-cyano-3-(1H-indol-3-yl)-2-methyl-propionic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C#N)C(=O)O

Isomeric SMILES

C[C@](CC1=CNC2=CC=CC=C21)(C#N)C(=O)O

InChI

InChI=1S/C13H12N2O2/c1-13(8-14,12(16)17)6-9-7-15-11-5-3-2-4-10(9)11/h2-5,7,15H,6H2,1H3,(H,16,17)/t13-/m0/s1