(2S)-1-butanoyl-2,3-dihydroindole-2-carboxylate

Systemtic Name: (2S)-1-butanoyl-2,3-dihydroindole-2-carboxylate Openeye Name: (2S)-1-butanoylindoline-2-carboxylate CAS Name: (2S)-1-(1-oxobutyl)-2,3-dihydroindole-2-carboxylate IUPAC Name: (2S)-1-butanoyl-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-butyrylindoline-2-carboxylate Formula: C13H14NO3- MolecularWeight: 232.25516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CCCC(=O)N1[C@@H](CC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C13H15NO3/c1-2-5-12(15)14-10-7-4-3-6-9(10)8-11(14)13(16)17/h3-4,6-7,11H,2,5,8H2,1H3,(H,16,17)/p-1/t11-/m0/s1