2-(3-fluoranyl-4-tetradecoxy-phenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide

Systemtic Name: 2-(3-fluoranyl-4-tetradecoxy-phenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide Openeye Name: 2-(3-fluoro-4-tetradecoxy-phenyl)-N-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide CAS Name: 2-(3-fluoro-4-tetradecoxyphenyl)-N-[2-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide IUPAC Name: 2-(3-fluoro-4-tetradecoxyphenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide Traditional Name: 2-(3-fluoro-4-myristyloxy-phenyl)-N-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide Formula: C33H46FN2O2S+ MolecularWeight: 553.793943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC=C2C[N+]3=CSC(=C3)C)F

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NC2=CC=CC=C2C[N+]3=CSC(=C3)C)F

InChI

InChI=1S/C33H45FN2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-16-21-38-32-20-19-28(22-30(32)34)23-33(37)35-31-18-15-14-17-29(31)25-36-24-27(2)39-26-36/h14-15,17-20,22,24,26H,3-13,16,21,23,25H2,1-2H3/p+1