dibutyl-[3-(4-nitrophenyl)carbonyloxypropyl]azanium

Systemtic Name: dibutyl-[3-(4-nitrophenyl)carbonyloxypropyl]azanium Openeye Name: dibutyl-[3-(4-nitrobenzoyl)oxypropyl]ammonium CAS Name: dibutyl-[3-[(4-nitrophenyl)-oxomethoxy]propyl]ammonium IUPAC Name: dibutyl-[3-(4-nitrobenzoyl)oxypropyl]azanium Traditional Name: dibutyl-[3-(4-nitrobenzoyl)oxypropyl]ammonium Formula: C18H29N2O4+ MolecularWeight: 337.43386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O4/c1-3-5-12-19(13-6-4-2)14-7-15-24-18(21)16-8-10-17(11-9-16)20(22)23/h8-11H,3-7,12-15H2,1-2H3/p+1