2-(3-tert-butyl-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]ethanamide

Systemtic Name: 2-(3-tert-butyl-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]ethanamide Openeye Name: 2-(3-tert-butyl-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide CAS Name: 2-(3-tert-butyl-4-dodecoxyphenoxy)-N-[2-(1-propyl-3-pyridin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(3-tert-butyl-4-dodecoxyphenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide Traditional Name: 2-(3-tert-butyl-4-lauryloxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide Formula: C34H55N2O3+ MolecularWeight: 539.8121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NCCC2=C[N+](=CC=C2)CCC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NCCC2=C[N+](=CC=C2)CCC)C(C)(C)C

InChI

InChI=1S/C34H54N2O3/c1-6-8-9-10-11-12-13-14-15-16-25-38-32-20-19-30(26-31(32)34(3,4)5)39-28-33(37)35-22-21-29-18-17-24-36(27-29)23-7-2/h17-20,24,26-27H,6-16,21-23,25,28H2,1-5H3/p+1