N-[1-(3-tert-butyl-4-tetradecoxy-phenyl)propyl]-1-ethyl-pyridin-1-ium-4-carboxamide

Systemtic Name: N-[1-(3-tert-butyl-4-tetradecoxy-phenyl)propyl]-1-ethyl-pyridin-1-ium-4-carboxamide Openeye Name: N-[1-(3-tert-butyl-4-tetradecoxy-phenyl)propyl]-1-ethyl-pyridin-1-ium-4-carboxamide CAS Name: N-[1-(3-tert-butyl-4-tetradecoxyphenyl)propyl]-1-ethyl-4-pyridin-1-iumcarboxamide IUPAC Name: N-[1-(3-tert-butyl-4-tetradecoxyphenyl)propyl]-1-ethylpyridin-1-ium-4-carboxamide Traditional Name: N-[1-(3-tert-butyl-4-myristyloxy-phenyl)propyl]-1-ethyl-pyridin-1-ium-4-carboxamide Formula: C35H57N2O2+ MolecularWeight: 537.83928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(CC)NC(=O)C2=CC=[N+](C=C2)CC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(CC)NC(=O)C2=CC=[N+](C=C2)CC)C(C)(C)C

InChI

InChI=1S/C35H56N2O2/c1-7-10-11-12-13-14-15-16-17-18-19-20-27-39-33-22-21-30(28-31(33)35(4,5)6)32(8-2)36-34(38)29-23-25-37(9-3)26-24-29/h21-26,28,32H,7-20,27H2,1-6H3/p+1