5-bromanyl-3-[2-(propanoylamino)ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-bromanyl-3-[2-(propanoylamino)ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-bromo-3-[2-(propanoylamino)ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-bromo-3-[2-(1-oxopropylamino)ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-bromo-3-[2-(propanoylamino)ethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-bromo-3-(2-propionamidoethyl)-1H-indole-2-carboxylic acid Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCC1=C(NC2=C1C=C(C=C2)Br)C(=O)O

Isomeric SMILES

CCC(=O)NCCC1=C(NC2=C1C=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C14H15BrN2O3/c1-2-12(18)16-6-5-9-10-7-8(15)3-4-11(10)17-13(9)14(19)20/h3-4,7,17H,2,5-6H2,1H3,(H,16,18)(H,19,20)