(2S)-2,6-bis(azanyl)hexanoic acid; 1,1,2-triisocyanatoethane

Systemtic Name: (2S)-2,6-bis(azanyl)hexanoic acid; 1,1,2-triisocyanatoethane Openeye Name: (2S)-2,6-diaminohexanoic acid; 1,1,2-triisocyanatoethane CAS Name: (2S)-2,6-diaminohexanoic acid; 1,1,2-triisocyanatoethane IUPAC Name: (2S)-2,6-diaminohexanoic acid; 1,1,2-triisocyanatoethane Traditional Name: (2S)-2,6-diaminohexanoic acid; 1,1,2-triisocyanatoethane Formula: C11H17N5O5 MolecularWeight: 299.28318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H14N2O2.C5H3N3O3/c7-4-2-1-3-5(8)6(9)10;9-2-6-1-5(7-3-10)8-4-11/h5H,1-4,7-8H2,(H,9,10);5H,1H2/t5-;/m0./s1