1,2,6-oxadiazine-2-carboxylate; tetrapentylazanium

Systemtic Name: 1,2,6-oxadiazine-2-carboxylate; tetrapentylazanium Openeye Name: 1,2,6-oxadiazine-2-carboxylate; tetrapentylammonium CAS Name: 1,2,6-oxadiazine-2-carboxylate; tetrapentylammonium IUPAC Name: 1,2,6-oxadiazine-2-carboxylate; tetrapentylazanium Traditional Name: 1,2,6-oxadiazine-2-carboxylate; tetraamylammonium Formula: C28H50N5O6- MolecularWeight: 552.7265

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCCC)(CCCCC)CCCCC.C1=CN(ON=C1)C(=O)[O-].C1=CN(ON=C1)C(=O)[O-]

Isomeric SMILES

CCCCC[N+](CCCCC)(CCCCC)CCCCC.C1=CN(ON=C1)C(=O)[O-].C1=CN(ON=C1)C(=O)[O-]

InChI

InChI=1S/C20H44N.2C4H4N2O3/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;2*7-4(8)6-3-1-2-5-9-6/h5-20H2,1-4H3;2*1-3H,(H,7,8)/q+1;;/p-2