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

Systemtic Name: 2-(3-ethanoyl-4-tetradecoxy-phenyl)-N-[3-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide bromide Openeye Name: 2-(3-acetyl-4-tetradecoxy-phenyl)-N-[3-[(2-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide CAS Name: 2-(3-acetyl-4-tetradecoxyphenyl)-N-[3-[(2-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide bromide IUPAC Name: 2-(3-acetyl-4-tetradecoxyphenyl)-N-[3-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Traditional Name: 2-(3-acetyl-4-myristyloxy-phenyl)-N-[3-[(2-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide bromide Formula: C35H49BrN2O3S MolecularWeight: 657.74416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C[N+]3=C(SC=C3)C)C(=O)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C[N+]3=C(SC=C3)C)C(=O)C.[Br-]

InChI

InChI=1S/C35H48N2O3S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-22-40-34-20-19-30(25-33(34)28(2)38)26-35(39)36-32-18-16-17-31(24-32)27-37-21-23-41-29(37)3;/h16-21,23-25H,4-15,22,26-27H2,1-3H3;1H