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

Systemtic Name: 2-(4-tert-butyl-3-tetradecoxy-phenyl)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: 2-(4-tert-butyl-3-tetradecoxy-phenyl)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: 2-(4-tert-butyl-3-tetradecoxyphenyl)-N-[4-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butyl-3-tetradecoxyphenyl)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: 2-(4-tert-butyl-3-myristyloxy-phenyl)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C36H53N2O2S+ MolecularWeight: 577.88322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)C(C)(C)C

InChI

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