ditert-butyl 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylate

Systemtic Name: ditert-butyl 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylate Openeye Name: ditert-butyl 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylate CAS Name: 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylate Traditional Name: 2-(1,3-benzodioxol-5-ylimino)imidazolidine-1,3-dicarboxylic acid ditert-butyl ester Formula: C20H27N3O6 MolecularWeight: 405.44488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C1=NC2=CC3=C(C=C2)OCO3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C1=NC2=CC3=C(C=C2)OCO3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27N3O6/c1-19(2,3)28-17(24)22-9-10-23(18(25)29-20(4,5)6)16(22)21-13-7-8-14-15(11-13)27-12-26-14/h7-8,11H,9-10,12H2,1-6H3