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

Systemtic Name: 2-(3-dodecoxy-4-methoxy-phenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide chloride Openeye Name: 2-(3-dodecoxy-4-methoxy-phenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride CAS Name: 2-(3-dodecoxy-4-methoxyphenyl)-N-[3-(3-methyl-2-thiazol-3-iumyl)phenyl]acetamide chloride IUPAC Name: 2-(3-dodecoxy-4-methoxyphenyl)-N-[3-(3-methyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide chloride Traditional Name: 2-(3-lauryloxy-4-methoxy-phenyl)-N-[3-(3-methylthiazol-3-ium-2-yl)phenyl]acetamide chloride Formula: C31H43ClN2O3S MolecularWeight: 559.20272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H42N2O3S.ClH/c1-4-5-6-7-8-9-10-11-12-13-20-36-29-22-25(17-18-28(29)35-3)23-30(34)32-27-16-14-15-26(24-27)31-33(2)19-21-37-31;/h14-19,21-22,24H,4-13,20,23H2,1-3H3;1H