(2,6-dinitrophenyl) (2S)-2,6-bis(azanyl)hexanoate

Systemtic Name: (2,6-dinitrophenyl) (2S)-2,6-bis(azanyl)hexanoate Openeye Name: (2,6-dinitrophenyl) (2S)-2,6-diaminohexanoate CAS Name: (2S)-2,6-diaminohexanoic acid (2,6-dinitrophenyl) ester IUPAC Name: (2,6-dinitrophenyl) (2S)-2,6-diaminohexanoate Traditional Name: (2S)-2,6-diaminohexanoic acid (2,6-dinitrophenyl) ester Formula: C12H16N4O6 MolecularWeight: 312.27864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])OC(=O)C(CCCCN)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])OC(=O)[C@H](CCCCN)N)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O6/c13-7-2-1-4-8(14)12(17)22-11-9(15(18)19)5-3-6-10(11)16(20)21/h3,5-6,8H,1-2,4,7,13-14H2/t8-/m0/s1