4-[1-[(2S)-1-oxidanidyl-1-oxidanylidene-butan-2-yl]-2,3-dihydroindol-5-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[1-[(2S)-1-oxidanidyl-1-oxidanylidene-butan-2-yl]-2,3-dihydroindol-5-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[1-[(1S)-1-carboxylatopropyl]indolin-5-yl]-4-oxo-butanoate CAS Name: 4-[1-[(2S)-1-oxido-1-oxobutan-2-yl]-2,3-dihydroindol-5-yl]-4-oxobutanoate IUPAC Name: 4-[1-[(2S)-1-oxido-1-oxobutan-2-yl]-2,3-dihydroindol-5-yl]-4-oxobutanoate Traditional Name: 4-[1-[(1S)-1-carboxylatopropyl]indolin-5-yl]-4-keto-butyrate Formula: C16H17NO5-2 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC[C@@H](C(=O)[O-])N1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C16H19NO5/c1-2-12(16(21)22)17-8-7-10-9-11(3-4-13(10)17)14(18)5-6-15(19)20/h3-4,9,12H,2,5-8H2,1H3,(H,19,20)(H,21,22)/p-2/t12-/m0/s1