3-(1-pentylindol-3-yl)propanoic acid

Systemtic Name: 3-(1-pentylindol-3-yl)propanoic acid Openeye Name: 3-(1-pentylindol-3-yl)propanoic acid CAS Name: 3-(1-pentyl-3-indolyl)propanoic acid IUPAC Name: 3-(1-pentylindol-3-yl)propanoic acid Traditional Name: 3-(1-amylindol-3-yl)propionic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C2=CC=CC=C21)CCC(=O)O

Isomeric SMILES

CCCCCN1C=C(C2=CC=CC=C21)CCC(=O)O

InChI

InChI=1S/C16H21NO2/c1-2-3-6-11-17-12-13(9-10-16(18)19)14-7-4-5-8-15(14)17/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,18,19)