(2S)-1-(5-oxidanyl-5-oxidanylidene-2-propan-2-yl-pentanoyl)-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: (2S)-1-(5-oxidanyl-5-oxidanylidene-2-propan-2-yl-pentanoyl)-2,3-dihydroindole-2-carboxylic acid Openeye Name: (2S)-1-(5-hydroxy-2-isopropyl-5-oxo-pentanoyl)indoline-2-carboxylic acid CAS Name: (2S)-1-(5-hydroxy-1,5-dioxo-2-propan-2-ylpentyl)-2,3-dihydroindole-2-carboxylic acid IUPAC Name: (2S)-1-(5-hydroxy-5-oxo-2-propan-2-ylpentanoyl)-2,3-dihydroindole-2-carboxylic acid Traditional Name: (2S)-1-(5-hydroxy-2-isopropyl-5-keto-pentanoyl)indoline-2-carboxylic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-10(2)12(7-8-15(19)20)16(21)18-13-6-4-3-5-11(13)9-14(18)17(22)23/h3-6,10,12,14H,7-9H2,1-2H3,(H,19,20)(H,22,23)/t12?,14-/m0/s1