(3S,4S)-4-methyl-3-(3-oxidanylidene-1H-isoindol-2-yl)hexanoate

Systemtic Name: (3S,4S)-4-methyl-3-(3-oxidanylidene-1H-isoindol-2-yl)hexanoate Openeye Name: (3S,4S)-4-methyl-3-(1-oxoisoindolin-2-yl)hexanoate CAS Name: (3S,4S)-4-methyl-3-(3-oxo-1H-isoindol-2-yl)hexanoate IUPAC Name: (3S,4S)-4-methyl-3-(3-oxo-1H-isoindol-2-yl)hexanoate Traditional Name: (3S,4S)-3-(1-ketoisoindolin-2-yl)-4-methyl-hexanoate Formula: C15H18NO3- MolecularWeight: 260.30832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC(=O)[O-])N1CC2=CC=CC=C2C1=O

Isomeric SMILES

CC[C@H](C)[C@H](CC(=O)[O-])N1CC2=CC=CC=C2C1=O

InChI

InChI=1S/C15H19NO3/c1-3-10(2)13(8-14(17)18)16-9-11-6-4-5-7-12(11)15(16)19/h4-7,10,13H,3,8-9H2,1-2H3,(H,17,18)/p-1/t10-,13-/m0/s1