4,6-dimethyl-5-nitro-3-propan-2-yl-3a,7a-dihydro-1H-isoindole

Systemtic Name: 4,6-dimethyl-5-nitro-3-propan-2-yl-3a,7a-dihydro-1H-isoindole Openeye Name: 3-isopropyl-4,6-dimethyl-5-nitro-3a,7a-dihydro-1H-isoindole CAS Name: 4,6-dimethyl-5-nitro-3-propan-2-yl-3a,7a-dihydro-1H-isoindole IUPAC Name: 4,6-dimethyl-5-nitro-3-propan-2-yl-3a,7a-dihydro-1H-isoindole Traditional Name: 3-isopropyl-4,6-dimethyl-5-nitro-3a,7a-dihydro-1H-isoindole Formula: C13H18N2O2 MolecularWeight: 234.29422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2CN=C(C2C(=C1[N+](=O)[O-])C)C(C)C

Isomeric SMILES

CC1=CC2CN=C(C2C(=C1[N+](=O)[O-])C)C(C)C

InChI

InChI=1S/C13H18N2O2/c1-7(2)12-11-9(4)13(15(16)17)8(3)5-10(11)6-14-12/h5,7,10-11H,6H2,1-4H3