6-azanyl-4-(2,3-dinitrophenyl)hexanoate

Systemtic Name: 6-azanyl-4-(2,3-dinitrophenyl)hexanoate Openeye Name: 6-amino-4-(2,3-dinitrophenyl)hexanoate CAS Name: 6-amino-4-(2,3-dinitrophenyl)hexanoate IUPAC Name: 6-amino-4-(2,3-dinitrophenyl)hexanoate Traditional Name: 6-amino-4-(2,3-dinitrophenyl)hexanoate Formula: C12H14N3O6- MolecularWeight: 296.25606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])C(CCC(=O)[O-])CCN

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])C(CCC(=O)[O-])CCN

InChI

InChI=1S/C12H15N3O6/c13-7-6-8(4-5-11(16)17)9-2-1-3-10(14(18)19)12(9)15(20)21/h1-3,8H,4-7,13H2,(H,16,17)/p-1