(3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,7aR)-2-(2-dimethylaminoethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C(C1)C(=O)N(C2=O)CCN(C)C

Isomeric SMILES

CC1=CC[C@@H]2[C@H](C1)C(=O)N(C2=O)CCN(C)C

InChI

InChI=1S/C13H20N2O2/c1-9-4-5-10-11(8-9)13(17)15(12(10)16)7-6-14(2)3/h4,10-11H,5-8H2,1-3H3/t10-,11+/m1/s1