N-tert-butyl-1-(2-dodecoxy-5-pyridin-1-ium-1-yl-phenyl)methanimine oxide chloride

Systemtic Name: N-tert-butyl-1-(2-dodecoxy-5-pyridin-1-ium-1-yl-phenyl)methanimine oxide chloride Openeye Name: N-tert-butyl-1-(2-dodecoxy-5-pyridin-1-ium-1-yl-phenyl)methanimine oxide chloride CAS Name: N-tert-butyl-1-[2-dodecoxy-5-(1-pyridin-1-iumyl)phenyl]methanimine oxide chloride IUPAC Name: N-tert-butyl-1-(2-dodecoxy-5-pyridin-1-ium-1-ylphenyl)methanimine oxide chloride Traditional Name: N-tert-butyl-1-(2-lauryloxy-5-pyridin-1-ium-1-yl-phenyl)methanimine oxide chloride Formula: C28H43ClN2O2 MolecularWeight: 475.10622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)[N+]2=CC=CC=C2)C=[N+](C(C)(C)C)[O-].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)[N+]2=CC=CC=C2)/C=[N+](/C(C)(C)C)\[O-].[Cl-]

InChI

InChI=1S/C28H43N2O2.ClH/c1-5-6-7-8-9-10-11-12-13-17-22-32-27-19-18-26(29-20-15-14-16-21-29)23-25(27)24-30(31)28(2,3)4;/h14-16,18-21,23-24H,5-13,17,22H2,1-4H3;1H/q+1;/p-1/b30-24-;