[2-(azonan-2-yl)-2-oxidanylidene-ethyl]-dimethyl-(3-triacontoxypropyl)azanium

Systemtic Name: [2-(azonan-2-yl)-2-oxidanylidene-ethyl]-dimethyl-(3-triacontoxypropyl)azanium Openeye Name: [2-(azonan-2-yl)-2-oxo-ethyl]-dimethyl-(3-triacontoxypropyl)ammonium CAS Name: [2-(2-azonanyl)-2-oxoethyl]-dimethyl-(3-triacontoxypropyl)ammonium IUPAC Name: [2-(azonan-2-yl)-2-oxoethyl]-dimethyl-(3-triacontoxypropyl)azanium Traditional Name: [2-(azonan-2-yl)-2-keto-ethyl]-(3-melissyloxypropyl)-dimethyl-ammonium Formula: C45H91N2O2+ MolecularWeight: 692.21624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOCCC[N+](C)(C)CC(=O)C1CCCCCCCN1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOCCC[N+](C)(C)CC(=O)C1CCCCCCCN1

InChI

InChI=1S/C45H91N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-33-36-41-49-42-37-40-47(2,3)43-45(48)44-38-34-31-30-32-35-39-46-44/h44,46H,4-43H2,1-3H3/q+1