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

Systemtic Name: 2-(3-tert-butyl-2-tetradecoxy-phenyl)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide Openeye Name: 2-(3-tert-butyl-2-tetradecoxy-phenyl)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide CAS Name: 2-(3-tert-butyl-2-tetradecoxyphenyl)-N-[3-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide IUPAC Name: 2-(3-tert-butyl-2-tetradecoxyphenyl)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide Traditional Name: 2-(3-tert-butyl-2-myristyloxy-phenyl)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide Formula: C37H55N2O2S+ MolecularWeight: 591.9098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1C(C)(C)C)CC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1C(C)(C)C)CC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C

InChI

InChI=1S/C37H54N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-17-24-41-36-32(21-19-23-34(36)37(3,4)5)26-35(40)38-33-22-18-20-31(25-33)27-39-29-42-28-30(39)2/h18-23,25,28-29H,6-17,24,26-27H2,1-5H3/p+1