4-[[6,6-dimethyl-8-(4-methylphenyl)-5H-naphthalen-2-yl]diazenyl]-3-fluoranyl-benzoic acid

Systemtic Name: 4-[[6,6-dimethyl-8-(4-methylphenyl)-5H-naphthalen-2-yl]diazenyl]-3-fluoranyl-benzoic acid Openeye Name: 4-[[6,6-dimethyl-8-(p-tolyl)-5H-naphthalen-2-yl]azo]-3-fluoro-benzoic acid CAS Name: 4-[[6,6-dimethyl-8-(4-methylphenyl)-5H-naphthalen-2-yl]azo]-3-fluorobenzoic acid IUPAC Name: 4-[[6,6-dimethyl-8-(4-methylphenyl)-5H-naphthalen-2-yl]diazenyl]-3-fluorobenzoic acid Traditional Name: 4-[[6,6-dimethyl-8-(p-tolyl)-5H-naphthalen-2-yl]azo]-3-fluoro-benzoic acid Formula: C26H23FN2O2 MolecularWeight: 414.471423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(CC3=C2C=C(C=C3)N=NC4=C(C=C(C=C4)C(=O)O)F)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(CC3=C2C=C(C=C3)N=NC4=C(C=C(C=C4)C(=O)O)F)(C)C

InChI

InChI=1S/C26H23FN2O2/c1-16-4-6-17(7-5-16)22-15-26(2,3)14-19-8-10-20(13-21(19)22)28-29-24-11-9-18(25(30)31)12-23(24)27/h4-13,15H,14H2,1-3H3,(H,30,31)