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

Systemtic Name: 2-(4-tert-butyl-2-tetradecoxy-phenyl)-N-[2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(4-tert-butyl-2-tetradecoxy-phenyl)-N-[2-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(4-tert-butyl-2-tetradecoxyphenyl)-N-[2-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(4-tert-butyl-2-tetradecoxyphenyl)-N-[2-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(4-tert-butyl-2-myristyloxy-phenyl)-N-[2-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride Formula: C36H53ClN2O2S MolecularWeight: 613.33622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(C)(C)C)CC(=O)NC2=CC=CC=C2C3=[N+](C=CS3)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(C)(C)C)CC(=O)NC2=CC=CC=C2C3=[N+](C=CS3)C.[Cl-]

InChI

InChI=1S/C36H52N2O2S.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-19-25-40-33-28-30(36(2,3)4)23-22-29(33)27-34(39)37-32-21-18-17-20-31(32)35-38(5)24-26-41-35;/h17-18,20-24,26,28H,6-16,19,25,27H2,1-5H3;1H