(2S)-2,6-bis(azanyl)hexanoic acid; (E)-4-oxidanylnon-2-enal

Systemtic Name: (2S)-2,6-bis(azanyl)hexanoic acid; (E)-4-oxidanylnon-2-enal Openeye Name: (2S)-2,6-diaminohexanoic acid; (E)-4-hydroxynon-2-enal CAS Name: (2S)-2,6-diaminohexanoic acid; (E)-4-hydroxy-2-nonenal IUPAC Name: (2S)-2,6-diaminohexanoic acid; (E)-4-hydroxynon-2-enal Traditional Name: (2S)-2,6-diaminohexanoic acid; (E)-4-hydroxynon-2-enal Formula: C15H30N2O4 MolecularWeight: 302.4097

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O2.C6H14N2O2/c1-2-3-4-6-9(11)7-5-8-10;7-4-2-1-3-5(8)6(9)10/h5,7-9,11H,2-4,6H2,1H3;5H,1-4,7-8H2,(H,9,10)/b7-5+;/t;5-/m.0/s1