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

Systemtic Name: N-(3-fluoranyl-4-tetradecoxy-phenyl)-3-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide Openeye Name: N-(3-fluoro-4-tetradecoxy-phenyl)-3-[(2-methylthiazol-3-ium-3-yl)methyl]benzamide CAS Name: N-(3-fluoro-4-tetradecoxyphenyl)-3-[(2-methyl-3-thiazol-3-iumyl)methyl]benzamide IUPAC Name: N-(3-fluoro-4-tetradecoxyphenyl)-3-[(2-methyl-1,3-thiazol-3-ium-3-yl)methyl]benzamide Traditional Name: N-(3-fluoro-4-myristyloxy-phenyl)-3-[(2-methylthiazol-3-ium-3-yl)methyl]benzamide Formula: C32H44FN2O2S+ MolecularWeight: 539.767363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C[N+]3=C(SC=C3)C)F

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C[N+]3=C(SC=C3)C)F

InChI

InChI=1S/C32H43FN2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-21-37-31-19-18-29(24-30(31)33)34-32(36)28-17-15-16-27(23-28)25-35-20-22-38-26(35)2/h15-20,22-24H,3-14,21,25H2,1-2H3/p+1