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

Systemtic Name: 2-(3-tert-butyl-4-dodecoxy-phenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(3-tert-butyl-4-dodecoxy-phenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(3-tert-butyl-4-dodecoxyphenyl)-N-[3-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(3-tert-butyl-4-dodecoxyphenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(3-tert-butyl-4-lauryloxy-phenyl)-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:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C)C(C)(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=[N+](C=CS3)C)C(C)(C)C.[Cl-]

InChI

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