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

Systemtic Name: 2-(4-hexadecoxyphenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(4-hexadecoxyphenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(4-hexadecoxyphenyl)-N-[3-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(4-hexadecoxyphenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(4-cetyloxyphenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride Formula: C34H49ClN2O2S MolecularWeight: 585.28306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C.[Cl-]

InChI

InChI=1S/C34H48N2O2S.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25-38-32-22-20-29(21-23-32)27-33(37)35-31-19-17-18-30(28-31)34-36(2)24-26-39-34;/h17-24,26,28H,3-16,25,27H2,1-2H3;1H