(3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one

Systemtic Name: (3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Openeye Name: (3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one CAS Name: (3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one IUPAC Name: (3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Traditional Name: (3R,3aS,7aR)-3-ethoxy-2,5-dimethyl-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C2CC(=CCC2C(=O)N1C)C

Isomeric SMILES

CCO[C@@H]1[C@H]2CC(=CC[C@H]2C(=O)N1C)C

InChI

InChI=1S/C12H19NO2/c1-4-15-12-10-7-8(2)5-6-9(10)11(14)13(12)3/h5,9-10,12H,4,6-7H2,1-3H3/t9-,10+,12-/m1/s1