ditert-butyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylate

Systemtic Name: ditert-butyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylate Openeye Name: ditert-butyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylimino)imidazolidine-1,3-dicarboxylic acid ditert-butyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C1=NC2=CC3=C(C=C2)OCCO3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C1=NC2=CC3=C(C=C2)OCCO3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H29N3O6/c1-20(2,3)29-18(25)23-9-10-24(19(26)30-21(4,5)6)17(23)22-14-7-8-15-16(13-14)28-12-11-27-15/h7-8,13H,9-12H2,1-6H3