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

Systemtic Name: 2-(3-hexadecoxyphenyl)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: 2-(3-hexadecoxyphenyl)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: 2-(3-hexadecoxyphenyl)-N-[4-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(3-hexadecoxyphenyl)-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: 2-(3-cetyloxyphenyl)-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C34H49N2O2S+ MolecularWeight: 549.83006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC(=C1)CC(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

InChI

InChI=1S/C34H48N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-38-33-18-16-17-31(26-33)27-34(37)35-32-21-19-30(20-22-32)28-36-23-25-39-29-36/h16-23,25-26,29H,2-15,24,27-28H2,1H3/p+1