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

Systemtic Name: 2-(2-hexadecoxyphenoxy)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: 2-(2-hexadecoxyphenoxy)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: 2-(2-hexadecoxyphenoxy)-N-[4-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(2-hexadecoxyphenoxy)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: 2-(2-cetyloxyphenoxy)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C34H49N2O3S+ MolecularWeight: 565.82946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC=C1OCC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC=C1OCC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

InChI

InChI=1S/C34H48N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-25-38-32-18-15-16-19-33(32)39-28-34(37)35-31-22-20-30(21-23-31)27-36-24-26-40-29-36/h15-16,18-24,26,29H,2-14,17,25,27-28H2,1H3/p+1