4-[(2-fluoranyl-5,5,8,8-tetramethyl-2-naphthalen-2-yl-hexadecanoyl)amino]benzoic acid

Systemtic Name: 4-[(2-fluoranyl-5,5,8,8-tetramethyl-2-naphthalen-2-yl-hexadecanoyl)amino]benzoic acid Openeye Name: 4-[[2-fluoro-5,5,8,8-tetramethyl-2-(2-naphthyl)hexadecanoyl]amino]benzoic acid CAS Name: 4-[[2-fluoro-5,5,8,8-tetramethyl-2-(2-naphthalenyl)-1-oxohexadecyl]amino]benzoic acid IUPAC Name: 4-[(2-fluoro-5,5,8,8-tetramethyl-2-naphthalen-2-ylhexadecanoyl)amino]benzoic acid Traditional Name: 4-[[2-fluoro-5,5,8,8-tetramethyl-2-(2-naphthyl)hexadecanoyl]amino]benzoic acid Formula: C37H50FNO3 MolecularWeight: 575.796203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C)(C)CCC(C)(C)CCC(C1=CC2=CC=CC=C2C=C1)(C(=O)NC3=CC=C(C=C3)C(=O)O)F

Isomeric SMILES

CCCCCCCCC(C)(C)CCC(C)(C)CCC(C1=CC2=CC=CC=C2C=C1)(C(=O)NC3=CC=C(C=C3)C(=O)O)F

InChI

InChI=1S/C37H50FNO3/c1-6-7-8-9-10-13-22-35(2,3)23-24-36(4,5)25-26-37(38,31-19-16-28-14-11-12-15-30(28)27-31)34(42)39-32-20-17-29(18-21-32)33(40)41/h11-12,14-21,27H,6-10,13,22-26H2,1-5H3,(H,39,42)(H,40,41)