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

Systemtic Name: (3aR,7aR)-5-methyl-2-(4-propylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aR,7aR)-5-methyl-2-(4-propylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aR,7aR)-5-methyl-2-(4-propylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aR,7aR)-5-methyl-2-(4-propylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aR,7aR)-5-methyl-2-(4-propylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2C(=O)C3CC=C(CC3C2=O)C

Isomeric SMILES

CCCC1=CC=C(C=C1)N2C(=O)[C@@H]3CC=C(C[C@H]3C2=O)C

InChI

InChI=1S/C18H21NO2/c1-3-4-13-6-8-14(9-7-13)19-17(20)15-10-5-12(2)11-16(15)18(19)21/h5-9,15-16H,3-4,10-11H2,1-2H3/t15-,16-/m1/s1