(2S)-2,6-bis(azanyl)-1-isocyanato-hexan-1-one

Systemtic Name: (2S)-2,6-bis(azanyl)-1-isocyanato-hexan-1-one Openeye Name: (2S)-2,6-diaminohexanoyl isocyanate CAS Name: (2S)-2,6-diamino-1-isocyanato-1-hexanone IUPAC Name: (2S)-2,6-diaminohexanoyl isocyanate Traditional Name: (2S)-2,6-diamino-1-isocyanato-hexan-1-one Formula: C7H13N3O2 MolecularWeight: 171.19702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13N3O2/c8-4-2-1-3-6(9)7(12)10-5-11/h6H,1-4,8-9H2/t6-/m0/s1