(3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-oxidanyl-3H-isoindol-1-one

Systemtic Name: (3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-oxidanyl-3H-isoindol-1-one Openeye Name: (3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-hydroxy-isoindolin-1-one CAS Name: (3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-hydroxy-3H-isoindol-1-one IUPAC Name: (3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-hydroxy-3H-isoindol-1-one Traditional Name: (3S)-2-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-3-hydroxy-isoindolin-1-one Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2C(C3=CC=CC=C3C2=O)O

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)N2[C@H](C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C16H21NO2/c1-10-6-5-9-14(11(10)2)17-15(18)12-7-3-4-8-13(12)16(17)19/h3-4,7-8,10-11,14-15,18H,5-6,9H2,1-2H3/t10-,11+,14-,15-/m0/s1