diethyl-(3-methylbutyl)-[4-(4-nitrophenyl)butyl]azanium

Systemtic Name: diethyl-(3-methylbutyl)-[4-(4-nitrophenyl)butyl]azanium Openeye Name: diethyl-isopentyl-[4-(4-nitrophenyl)butyl]ammonium CAS Name: diethyl-(3-methylbutyl)-[4-(4-nitrophenyl)butyl]ammonium IUPAC Name: diethyl-(3-methylbutyl)-[4-(4-nitrophenyl)butyl]azanium Traditional Name: diethyl-isoamyl-[4-(4-nitrophenyl)butyl]ammonium Formula: C19H33N2O2+ MolecularWeight: 321.47752

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCC1=CC=C(C=C1)[N+](=O)[O-])CCC(C)C

Isomeric SMILES

CC[N+](CC)(CCCCC1=CC=C(C=C1)[N+](=O)[O-])CCC(C)C

InChI

InChI=1S/C19H33N2O2/c1-5-21(6-2,16-14-17(3)4)15-8-7-9-18-10-12-19(13-11-18)20(22)23/h10-13,17H,5-9,14-16H2,1-4H3/q+1