2-azanylethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)azanium

Systemtic Name: 2-azanylethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)azanium Openeye Name: 2-aminoethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)ammonium CAS Name: 2-aminoethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)ammonium IUPAC Name: 2-aminoethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)azanium Traditional Name: 2-aminoethyl-ethyl-(5-methylhexyl)-(4-nitrophenyl)ammonium Formula: C17H30N3O2+ MolecularWeight: 308.439

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N3O2/c1-4-20(14-12-18,13-6-5-7-15(2)3)17-10-8-16(9-11-17)19(21)22/h8-11,15H,4-7,12-14,18H2,1-3H3/q+1