2-acetamido-3-(5-bromanyl-1H-indol-4-yl)propanoic acid

Systemtic Name: 2-acetamido-3-(5-bromanyl-1H-indol-4-yl)propanoic acid Openeye Name: 2-acetamido-3-(5-bromo-1H-indol-4-yl)propanoic acid CAS Name: 2-acetamido-3-(5-bromo-1H-indol-4-yl)propanoic acid IUPAC Name: 2-acetamido-3-(5-bromo-1H-indol-4-yl)propanoic acid Traditional Name: 2-acetamido-3-(5-bromo-1H-indol-4-yl)propionic acid Formula: C13H13BrN2O3 MolecularWeight: 325.15792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(C=CC2=C1C=CN2)Br)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=C(C=CC2=C1C=CN2)Br)C(=O)O

InChI

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