1-(2-ethylhexanoyl)-2,3-dihydroindole-5-carboxylic acid

Systemtic Name: 1-(2-ethylhexanoyl)-2,3-dihydroindole-5-carboxylic acid Openeye Name: 1-(2-ethylhexanoyl)indoline-5-carboxylic acid CAS Name: 1-(2-ethyl-1-oxohexyl)-2,3-dihydroindole-5-carboxylic acid IUPAC Name: 1-(2-ethylhexanoyl)-2,3-dihydroindole-5-carboxylic acid Traditional Name: 1-(2-ethylhexanoyl)indoline-5-carboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCC2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CCCCC(CC)C(=O)N1CCC2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C17H23NO3/c1-3-5-6-12(4-2)16(19)18-10-9-13-11-14(17(20)21)7-8-15(13)18/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,20,21)