2-indol-1-yloctanoic acid

Systemtic Name: 2-indol-1-yloctanoic acid Openeye Name: 2-indol-1-yloctanoic acid CAS Name: 2-(1-indolyl)octanoic acid IUPAC Name: 2-indol-1-yloctanoic acid Traditional Name: 2-indol-1-ylcaprylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)N1C=CC2=CC=CC=C21

Isomeric SMILES

CCCCCCC(C(=O)O)N1C=CC2=CC=CC=C21

InChI

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