6-[2-[4-(carboxymethyl)-3-fluoranyl-phenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid

Systemtic Name: 6-[2-[4-(carboxymethyl)-3-fluoranyl-phenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid Openeye Name: 6-[2-[4-(carboxymethyl)-3-fluoro-phenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid CAS Name: 6-[2-[4-(carboxymethyl)-3-fluorophenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid IUPAC Name: 6-[2-[4-(carboxymethyl)-3-fluorophenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid Traditional Name: 6-[2-[4-(carboxymethyl)-3-fluoro-phenyl]ethynyl]-2,4,4-trimethyl-3H-naphthalene-1-carboxylic acid Formula: C24H21FO4 MolecularWeight: 392.419543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)O)F)C(C1)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)O)F)C(C1)(C)C)C(=O)O

InChI

InChI=1S/C24H21FO4/c1-14-13-24(2,3)19-10-15(7-9-18(19)22(14)23(28)29)4-5-16-6-8-17(12-21(26)27)20(25)11-16/h6-11H,12-13H2,1-3H3,(H,26,27)(H,28,29)