N-(2-methoxy-3-octadecoxy-propoxy)-N-(2-pyridin-1-ium-1-ylethyl)methanamide chloride

Systemtic Name: N-(2-methoxy-3-octadecoxy-propoxy)-N-(2-pyridin-1-ium-1-ylethyl)methanamide chloride Openeye Name: N-(2-methoxy-3-octadecoxy-propoxy)-N-(2-pyridin-1-ium-1-ylethyl)formamide chloride CAS Name: N-(2-methoxy-3-octadecoxypropoxy)-N-[2-(1-pyridin-1-iumyl)ethyl]formamide chloride IUPAC Name: N-(2-methoxy-3-octadecoxypropoxy)-N-(2-pyridin-1-ium-1-ylethyl)formamide chloride Traditional Name: N-(2-methoxy-3-stearyloxy-propoxy)-N-(2-pyridin-1-ium-1-ylethyl)formamide chloride Formula: C30H55ClN2O4 MolecularWeight: 543.2217

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CON(CC[N+]1=CC=CC=C1)C=O)OC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CON(CC[N+]1=CC=CC=C1)C=O)OC.[Cl-]

InChI

InChI=1S/C30H55N2O4.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-35-27-30(34-2)28-36-32(29-33)25-24-31-22-19-18-20-23-31;/h18-20,22-23,29-30H,3-17,21,24-28H2,1-2H3;1H/q+1;/p-1