2-azanyl-3-[(4-bromanyl-1H-indol-3-yl)carbonylamino]propanoic acid

Systemtic Name: 2-azanyl-3-[(4-bromanyl-1H-indol-3-yl)carbonylamino]propanoic acid Openeye Name: 2-amino-3-[(4-bromo-1H-indole-3-carbonyl)amino]propanoic acid CAS Name: 2-amino-3-[[(4-bromo-1H-indol-3-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-amino-3-[(4-bromo-1H-indole-3-carbonyl)amino]propanoic acid Traditional Name: 2-amino-3-[(4-bromo-1H-indole-3-carbonyl)amino]propionic acid Formula: C12H12BrN3O3 MolecularWeight: 326.14598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CN2)C(=O)NCC(C(=O)O)N

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CN2)C(=O)NCC(C(=O)O)N

InChI

InChI=1S/C12H12BrN3O3/c13-7-2-1-3-9-10(7)6(4-15-9)11(17)16-5-8(14)12(18)19/h1-4,8,15H,5,14H2,(H,16,17)(H,18,19)