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

Systemtic Name: 2-(3-tert-butyl-2-tetradecoxy-phenyl)-N-[4-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(3-tert-butyl-2-tetradecoxy-phenyl)-N-[4-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(3-tert-butyl-2-tetradecoxyphenyl)-N-[4-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(3-tert-butyl-2-tetradecoxyphenyl)-N-[4-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(3-tert-butyl-2-myristyloxy-phenyl)-N-[4-(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=C1C(C)(C)C)CC(=O)NC2=CC=C(C=C2)C3=[N+](C=CS3)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1C(C)(C)C)CC(=O)NC2=CC=C(C=C2)C3=[N+](C=CS3)C.[Cl-]

InChI

InChI=1S/C36H52N2O2S.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-26-40-34-30(19-18-20-32(34)36(2,3)4)28-33(39)37-31-23-21-29(22-24-31)35-38(5)25-27-41-35;/h18-25,27H,6-17,26,28H2,1-5H3;1H