5-fluoranyl-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylic acid

Systemtic Name: 5-fluoranyl-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylic acid Openeye Name: 5-fluoro-3-(isopropylcarbamoylamino)-1H-indole-2-carboxylic acid CAS Name: 5-fluoro-3-[[oxo-(propan-2-ylamino)methyl]amino]-1H-indole-2-carboxylic acid IUPAC Name: 5-fluoro-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylic acid Traditional Name: 5-fluoro-3-(isopropylcarbamoylamino)-1H-indole-2-carboxylic acid Formula: C13H14FN3O3 MolecularWeight: 279.266963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)O

Isomeric SMILES

CC(C)NC(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)O

InChI

InChI=1S/C13H14FN3O3/c1-6(2)15-13(20)17-10-8-5-7(14)3-4-9(8)16-11(10)12(18)19/h3-6,16H,1-2H3,(H,18,19)(H2,15,17,20)