(4-carboxy-2,6-dinitro-phenyl)-bis(prop-2-enyl)-propyl-azanium

Systemtic Name: (4-carboxy-2,6-dinitro-phenyl)-bis(prop-2-enyl)-propyl-azanium Openeye Name: diallyl-(4-carboxy-2,6-dinitro-phenyl)-propyl-ammonium CAS Name: (4-carboxy-2,6-dinitrophenyl)-bis(prop-2-enyl)-propylammonium IUPAC Name: (4-carboxy-2,6-dinitrophenyl)-bis(prop-2-enyl)-propylazanium Traditional Name: diallyl-(4-carboxy-2,6-dinitro-phenyl)-propyl-ammonium Formula: C16H20N3O6+ MolecularWeight: 350.3465

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O6/c1-4-7-19(8-5-2,9-6-3)15-13(17(22)23)10-12(16(20)21)11-14(15)18(24)25/h4-5,10-11H,1-2,6-9H2,3H3/p+1