2-pentadecoxyethyl 2-pyridin-1-ium-1-ylethyl hydrogen phosphate

Systemtic Name: 2-pentadecoxyethyl 2-pyridin-1-ium-1-ylethyl hydrogen phosphate Openeye Name: 2-pentadecoxyethyl 2-pyridin-1-ium-1-ylethyl hydrogen phosphate CAS Name: 2-pentadecoxyethyl 2-(1-pyridin-1-iumyl)ethyl hydrogen phosphate IUPAC Name: 2-pentadecoxyethyl 2-pyridin-1-ium-1-ylethyl hydrogen phosphate Traditional Name: 2-pentadecoxyethyl 2-pyridin-1-ium-1-ylethyl hydrogen phosphate Formula: C24H45NO5P+ MolecularWeight: 458.591561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCCOP(=O)(O)OCC[N+]1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCOCCOP(=O)(O)OCC[N+]1=CC=CC=C1

InChI

InChI=1S/C24H44NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-21-28-23-24-30-31(26,27)29-22-20-25-18-15-14-16-19-25/h14-16,18-19H,2-13,17,20-24H2,1H3/p+1