aminocarbonylcarbamoyl-tris(6-isocyanatohexyl)azanium

Systemtic Name: aminocarbonylcarbamoyl-tris(6-isocyanatohexyl)azanium Openeye Name: allophanoyl-tris(6-isocyanatohexyl)ammonium CAS Name: [(carbamoylamino)-oxomethyl]-tris(6-isocyanatohexyl)ammonium IUPAC Name: carbamoylcarbamoyl-tris(6-isocyanatohexyl)azanium Traditional Name: allophanoyl-tris(6-isocyanatohexyl)ammonium Formula: C23H39N6O5+ MolecularWeight: 479.59296

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC[N+](CCCCCCN=C=O)(CCCCCCN=C=O)C(=O)NC(=O)N)CCN=C=O

Isomeric SMILES

C(CCC[N+](CCCCCCN=C=O)(CCCCCCN=C=O)C(=O)NC(=O)N)CCN=C=O

InChI

InChI=1S/C23H38N6O5/c24-22(33)28-23(34)29(16-10-4-1-7-13-25-19-30,17-11-5-2-8-14-26-20-31)18-12-6-3-9-15-27-21-32/h1-18H2,(H2-,24,28,33,34)/p+1