2-[(2S)-1-cyclohexylpropan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[(2S)-1-cyclohexylpropan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[(1S)-2-cyclohexyl-1-methyl-ethyl]isoindolin-1-one CAS Name: 2-[(2S)-1-cyclohexylpropan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[(2S)-1-cyclohexylpropan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[(1S)-2-cyclohexyl-1-methyl-ethyl]isoindolin-1-one Formula: C17H23NO MolecularWeight: 257.37062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCCCC1)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

C[C@@H](CC1CCCCC1)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H23NO/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17(18)19/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3/t13-/m0/s1