2-(3-ethanoyl-4-tetradecoxy-phenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide

Systemtic Name: 2-(3-ethanoyl-4-tetradecoxy-phenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide Openeye Name: 2-(3-acetyl-4-tetradecoxy-phenoxy)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide CAS Name: 2-(3-acetyl-4-tetradecoxyphenoxy)-N-[3-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide bromide IUPAC Name: 2-(3-acetyl-4-tetradecoxyphenoxy)-N-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Traditional Name: 2-(3-acetyl-4-myristyloxy-phenoxy)-N-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Formula: C35H49BrN2O4S MolecularWeight: 673.74356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C)C(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C)C(=O)C.[Br-]

InChI

InChI=1S/C35H48N2O4S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-21-40-34-20-19-32(23-33(34)29(3)38)41-25-35(39)36-31-18-16-17-30(22-31)24-37-27-42-26-28(37)2;/h16-20,22-23,26-27H,4-15,21,24-25H2,1-3H3;1H