2-(4-chloranyl-3-dodecoxy-phenyl)-N-[4-(3-ethyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-dodecoxy-phenyl)-N-[4-(3-ethyl-1,3-thiazol-3-ium-2-yl)phenyl]ethanamide Openeye Name: 2-(4-chloro-3-dodecoxy-phenyl)-N-[4-(3-ethylthiazol-3-ium-2-yl)phenyl]acetamide CAS Name: 2-(4-chloro-3-dodecoxyphenyl)-N-[4-(3-ethyl-2-thiazol-3-iumyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-3-dodecoxyphenyl)-N-[4-(3-ethyl-1,3-thiazol-3-ium-2-yl)phenyl]acetamide Traditional Name: 2-(4-chloro-3-lauryloxy-phenyl)-N-[4-(3-ethylthiazol-3-ium-2-yl)phenyl]acetamide Formula: C31H42ClN2O2S+ MolecularWeight: 542.19538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H41ClN2O2S/c1-3-5-6-7-8-9-10-11-12-13-21-36-29-23-25(14-19-28(29)32)24-30(35)33-27-17-15-26(16-18-27)31-34(4-2)20-22-37-31/h14-20,22-23H,3-13,21,24H2,1-2H3/p+1