1-heptylindole-2-carboxylic acid

Systemtic Name: 1-heptylindole-2-carboxylic acid Openeye Name: 1-heptylindole-2-carboxylic acid CAS Name: 1-heptyl-2-indolecarboxylic acid IUPAC Name: 1-heptylindole-2-carboxylic acid Traditional Name: 1-heptylindole-2-carboxylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C=C1C(=O)O

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2C=C1C(=O)O

InChI

InChI=1S/C16H21NO2/c1-2-3-4-5-8-11-17-14-10-7-6-9-13(14)12-15(17)16(18)19/h6-7,9-10,12H,2-5,8,11H2,1H3,(H,18,19)