1-(2-ethylhexanoyl)-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-(2-ethylhexanoyl)-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-(2-ethylhexanoyl)indoline-2-carboxylic acid CAS Name: 1-(2-ethyl-1-oxohexyl)-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-(2-ethylhexanoyl)-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-(2-ethylhexanoyl)indoline-2-carboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-3-5-8-12(4-2)16(19)18-14-10-7-6-9-13(14)11-15(18)17(20)21/h6-7,9-10,12,15H,3-5,8,11H2,1-2H3,(H,20,21)