2-[(2S,3S)-3,7-dimethyl-2,3-bis(oxidanyl)oct-6-enyl]isoindole-1,3-dione

Systemtic Name: 2-[(2S,3S)-3,7-dimethyl-2,3-bis(oxidanyl)oct-6-enyl]isoindole-1,3-dione Openeye Name: 2-[(2S,3S)-2,3-dihydroxy-3,7-dimethyl-oct-6-enyl]isoindoline-1,3-dione CAS Name: 2-[(2S,3S)-2,3-dihydroxy-3,7-dimethyloct-6-enyl]isoindole-1,3-dione IUPAC Name: 2-[(2S,3S)-2,3-dihydroxy-3,7-dimethyloct-6-enyl]isoindole-1,3-dione Traditional Name: 2-[(2S,3S)-2,3-dihydroxy-3,7-dimethyl-oct-6-enyl]isoindoline-1,3-quinone Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C(CN1C(=O)C2=CC=CC=C2C1=O)O)O)C

Isomeric SMILES

CC(=CCC[C@@](C)([C@H](CN1C(=O)C2=CC=CC=C2C1=O)O)O)C

InChI

InChI=1S/C18H23NO4/c1-12(2)7-6-10-18(3,23)15(20)11-19-16(21)13-8-4-5-9-14(13)17(19)22/h4-5,7-9,15,20,23H,6,10-11H2,1-3H3/t15-,18-/m0/s1