(2S)-2-acetamido-4-(1H-indol-3-yl)butanoate

Systemtic Name: (2S)-2-acetamido-4-(1H-indol-3-yl)butanoate Openeye Name: (2S)-2-acetamido-4-(1H-indol-3-yl)butanoate CAS Name: (2S)-2-acetamido-4-(1H-indol-3-yl)butanoate IUPAC Name: (2S)-2-acetamido-4-(1H-indol-3-yl)butanoate Traditional Name: (2S)-2-acetamido-4-(1H-indol-3-yl)butyrate Formula: C14H15N2O3- MolecularWeight: 259.2805

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CC(=O)N[C@@H](CCC1=CNC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C14H16N2O3/c1-9(17)16-13(14(18)19)7-6-10-8-15-12-5-3-2-4-11(10)12/h2-5,8,13,15H,6-7H2,1H3,(H,16,17)(H,18,19)/p-1/t13-/m0/s1