ditert-butyl (3aR,7aR)-2-prop-2-enyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylate

Systemtic Name: ditert-butyl (3aR,7aR)-2-prop-2-enyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylate Openeye Name: ditert-butyl (3aR,7aR)-2-allyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylate CAS Name: (3aR,7aR)-2-prop-2-enyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (3aR,7aR)-2-prop-2-enyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylate Traditional Name: (3aR,7aR)-2-allyl-3a,4,5,6,7,7a-hexahydro-2H-benzimidazole-1,3-dicarboxylic acid ditert-butyl ester Formula: C20H34N2O4 MolecularWeight: 366.49496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCCCC2N(C1CC=C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]2CCCC[C@H]2N(C1CC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H34N2O4/c1-8-11-16-21(17(23)25-19(2,3)4)14-12-9-10-13-15(14)22(16)18(24)26-20(5,6)7/h8,14-16H,1,9-13H2,2-7H3/t14-,15-/m1/s1