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

Systemtic Name: 2-(4-tert-butyl-2-tetradecoxy-phenyl)-N-[4-(3-ethyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(4-tert-butyl-2-tetradecoxy-phenyl)-N-[4-(3-ethylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(4-tert-butyl-2-tetradecoxyphenyl)-N-[4-(3-ethyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(4-tert-butyl-2-tetradecoxyphenyl)-N-[4-(3-ethyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(4-tert-butyl-2-myristyloxy-phenyl)-N-[4-(3-ethylthiazol-3-ium-2-yl)phenyl]acetamide chloride Formula: C37H55ClN2O2S MolecularWeight: 627.3628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(C)(C)C)CC(=O)NC2=CC=C(C=C2)C3=[N+](C=CS3)CC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(C)(C)C)CC(=O)NC2=CC=C(C=C2)C3=[N+](C=CS3)CC.[Cl-]

InChI

InChI=1S/C37H54N2O2S.ClH/c1-6-8-9-10-11-12-13-14-15-16-17-18-26-41-34-29-32(37(3,4)5)22-19-31(34)28-35(40)38-33-23-20-30(21-24-33)36-39(7-2)25-27-42-36;/h19-25,27,29H,6-18,26,28H2,1-5H3;1H