3-octyl-1H-indole-5-carboxylic acid

Systemtic Name: 3-octyl-1H-indole-5-carboxylic acid Openeye Name: 3-octyl-1H-indole-5-carboxylic acid CAS Name: 3-octyl-1H-indole-5-carboxylic acid IUPAC Name: 3-octyl-1H-indole-5-carboxylic acid Traditional Name: 3-octyl-1H-indole-5-carboxylic acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CNC2=C1C=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CNC2=C1C=C(C=C2)C(=O)O

InChI

InChI=1S/C17H23NO2/c1-2-3-4-5-6-7-8-14-12-18-16-10-9-13(17(19)20)11-15(14)16/h9-12,18H,2-8H2,1H3,(H,19,20)