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

Systemtic Name: 2-(4-tert-butyl-3-tetradecoxy-phenoxy)-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: 2-(4-tert-butyl-3-tetradecoxy-phenoxy)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: 2-(4-tert-butyl-3-tetradecoxyphenoxy)-N-[3-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butyl-3-tetradecoxyphenoxy)-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: 2-(4-tert-butyl-3-myristyloxy-phenoxy)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C36H53N2O3S+ MolecularWeight: 593.88262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H52N2O3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-23-40-34-26-32(20-21-33(34)36(2,3)4)41-28-35(39)37-31-19-17-18-30(25-31)27-38-22-24-42-29-38/h17-22,24-26,29H,5-16,23,27-28H2,1-4H3/p+1