2-chloranyl-1-octyl-indole-3-carboxylic acid

Systemtic Name: 2-chloranyl-1-octyl-indole-3-carboxylic acid Openeye Name: 2-chloro-1-octyl-indole-3-carboxylic acid CAS Name: 2-chloro-1-octyl-3-indolecarboxylic acid IUPAC Name: 2-chloro-1-octylindole-3-carboxylic acid Traditional Name: 2-chloro-1-octyl-indole-3-carboxylic acid Formula: C17H22ClNO2 MolecularWeight: 307.81508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2C(=C1Cl)C(=O)O

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2C(=C1Cl)C(=O)O

InChI

InChI=1S/C17H22ClNO2/c1-2-3-4-5-6-9-12-19-14-11-8-7-10-13(14)15(16(19)18)17(20)21/h7-8,10-11H,2-6,9,12H2,1H3,(H,20,21)