(2S)-6-azanyl-2-(diisocyanatoamino)-1-isocyanato-hexan-1-one

Systemtic Name: (2S)-6-azanyl-2-(diisocyanatoamino)-1-isocyanato-hexan-1-one Openeye Name: (2S)-6-amino-2-(diisocyanatoamino)hexanoyl isocyanate CAS Name: (2S)-6-amino-2-(diisocyanatoamino)-1-isocyanato-1-hexanone IUPAC Name: (2S)-6-amino-2-(diisocyanatoamino)hexanoyl isocyanate Traditional Name: (2S)-6-amino-2-(diisocyanatoamino)-1-isocyanato-hexan-1-one Formula: C9H11N5O4 MolecularWeight: 253.21474

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)N=C=O)N(N=C=O)N=C=O

Isomeric SMILES

C(CCN)C[C@@H](C(=O)N=C=O)N(N=C=O)N=C=O

InChI

InChI=1S/C9H11N5O4/c10-4-2-1-3-8(9(18)11-5-15)14(12-6-16)13-7-17/h8H,1-4,10H2/t8-/m0/s1