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

Systemtic Name: 6-[2-[4-(carboxymethyl)-3-fluoranyl-phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Openeye Name: 6-[2-[4-(carboxymethyl)-3-fluoro-phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid CAS Name: 6-[2-[4-(carboxymethyl)-3-fluorophenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid IUPAC Name: 6-[2-[4-(carboxymethyl)-3-fluorophenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Traditional Name: 6-[2-[4-(carboxymethyl)-3-fluoro-phenyl]ethynyl]-4,4-dimethyl-3H-naphthalene-1-carboxylic acid Formula: C23H19FO4 MolecularWeight: 378.392963

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)O)F)C(=O)O)C

Isomeric SMILES

CC1(CC=C(C2=C1C=C(C=C2)C#CC3=CC(=C(C=C3)CC(=O)O)F)C(=O)O)C

InChI

InChI=1S/C23H19FO4/c1-23(2)10-9-18(22(27)28)17-8-6-14(11-19(17)23)3-4-15-5-7-16(13-21(25)26)20(24)12-15/h5-9,11-12H,10,13H2,1-2H3,(H,25,26)(H,27,28)