2-(hydroxymethyl)-5-nitro-benzoate; tetrabutylazanium

Systemtic Name: 2-(hydroxymethyl)-5-nitro-benzoate; tetrabutylazanium Openeye Name: 2-(hydroxymethyl)-5-nitro-benzoate; tetrabutylammonium CAS Name: 2-(hydroxymethyl)-5-nitrobenzoate; tetrabutylammonium IUPAC Name: 2-(hydroxymethyl)-5-nitrobenzoate; tetrabutylazanium Traditional Name: 2-methylol-5-nitro-benzoate; tetrabutylammonium Formula: C24H42N2O5 MolecularWeight: 438.60068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)[O-])CO

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)[O-])CO

InChI

InChI=1S/C16H36N.C8H7NO5/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;10-4-5-1-2-6(9(13)14)3-7(5)8(11)12/h5-16H2,1-4H3;1-3,10H,4H2,(H,11,12)/q+1;/p-1