(2S)-2-acetamido-3-(7-bromanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-acetamido-3-(7-bromanyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-acetamido-3-(7-bromo-1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-acetamido-3-(7-bromo-1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-acetamido-3-(7-bromo-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-acetamido-3-(7-bromo-1H-indol-3-yl)propionic acid Formula: C13H13BrN2O3 MolecularWeight: 325.15792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=C1C=CC=C2Br)C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=C1C=CC=C2Br)C(=O)O

InChI

InChI=1S/C13H13BrN2O3/c1-7(17)16-11(13(18)19)5-8-6-15-12-9(8)3-2-4-10(12)14/h2-4,6,11,15H,5H2,1H3,(H,16,17)(H,18,19)/t11-/m0/s1