ditert-butyl 2-azanyl-2-[5-[6-(6-azanylhexylamino)hexylamino]pentyl]propanedioate

Systemtic Name: ditert-butyl 2-azanyl-2-[5-[6-(6-azanylhexylamino)hexylamino]pentyl]propanedioate Openeye Name: ditert-butyl 2-amino-2-[5-[6-(6-aminohexylamino)hexylamino]pentyl]propanedioate CAS Name: 2-amino-2-[5-[6-(6-aminohexylamino)hexylamino]pentyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-amino-2-[5-[6-(6-aminohexylamino)hexylamino]pentyl]propanedioate Traditional Name: 2-amino-2-[5-[6-(6-aminohexylamino)hexylamino]pentyl]malonic acid ditert-butyl ester Formula: C28H58N4O4 MolecularWeight: 514.78452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCCNCCCCCCNCCCCCCN)(C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCCNCCCCCCNCCCCCCN)(C(=O)OC(C)(C)C)N

InChI

InChI=1S/C28H58N4O4/c1-26(2,3)35-24(33)28(30,25(34)36-27(4,5)6)18-12-11-17-23-32-22-16-10-9-15-21-31-20-14-8-7-13-19-29/h31-32H,7-23,29-30H2,1-6H3