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

Systemtic Name: (2S)-1-(3,3-dimethylbutanoyl)-2,3-dihydroindole-2-carboxylate Openeye Name: (2S)-1-(3,3-dimethylbutanoyl)indoline-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1-oxobutyl)-2,3-dihydroindole-2-carboxylate IUPAC Name: (2S)-1-(3,3-dimethylbutanoyl)-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-(3,3-dimethylbutanoyl)indoline-2-carboxylate Formula: C15H18NO3- MolecularWeight: 260.30832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-15(2,3)9-13(17)16-11-7-5-4-6-10(11)8-12(16)14(18)19/h4-7,12H,8-9H2,1-3H3,(H,18,19)/p-1/t12-/m0/s1