3-(4-azanyl-3-nitro-phenoxy)propyl-diethyl-azanium

Systemtic Name: 3-(4-azanyl-3-nitro-phenoxy)propyl-diethyl-azanium Openeye Name: 3-(4-amino-3-nitro-phenoxy)propyl-diethyl-ammonium CAS Name: 3-(4-amino-3-nitrophenoxy)propyl-diethylammonium IUPAC Name: 3-(4-amino-3-nitrophenoxy)propyl-diethylazanium Traditional Name: 3-(4-amino-3-nitro-phenoxy)propyl-diethyl-ammonium Formula: C13H22N3O3+ MolecularWeight: 268.33208

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCOC1=CC(=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCCOC1=CC(=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O3/c1-3-15(4-2)8-5-9-19-11-6-7-12(14)13(10-11)16(17)18/h6-7,10H,3-5,8-9,14H2,1-2H3/p+1