N-(3-tert-butyl-4-tetradecoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]ethanamide

Systemtic Name: N-(3-tert-butyl-4-tetradecoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]ethanamide Openeye Name: N-(3-tert-butyl-4-tetradecoxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide CAS Name: N-(3-tert-butyl-4-tetradecoxyphenyl)-N-[(1-propyl-2-pyridin-1-iumyl)methyl]acetamide IUPAC Name: N-(3-tert-butyl-4-tetradecoxyphenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide Traditional Name: N-(3-tert-butyl-4-myristyloxy-phenyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]acetamide Formula: C35H57N2O2+ MolecularWeight: 537.83928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2CCC)C(=O)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=CC=[N+]2CCC)C(=O)C)C(C)(C)C

InChI

InChI=1S/C35H57N2O2/c1-7-9-10-11-12-13-14-15-16-17-18-21-27-39-34-24-23-31(28-33(34)35(4,5)6)37(30(3)38)29-32-22-19-20-26-36(32)25-8-2/h19-20,22-24,26,28H,7-18,21,25,27,29H2,1-6H3/q+1