2-[4-[(4-cyanophenyl)methyl]-6-fluoranyl-3-methyl-naphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[4-[(4-cyanophenyl)methyl]-6-fluoranyl-3-methyl-naphthalen-2-yl]ethanoic acid Openeye Name: 2-[4-[(4-cyanophenyl)methyl]-6-fluoro-3-methyl-2-naphthyl]acetic acid CAS Name: 2-[4-[(4-cyanophenyl)methyl]-6-fluoro-3-methyl-2-naphthalenyl]acetic acid IUPAC Name: 2-[4-[(4-cyanophenyl)methyl]-6-fluoro-3-methylnaphthalen-2-yl]acetic acid Traditional Name: 2-[4-(4-cyanobenzyl)-6-fluoro-3-methyl-2-naphthyl]acetic acid Formula: C21H16FNO2 MolecularWeight: 333.355643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=C1CC3=CC=C(C=C3)C#N)F)CC(=O)O

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=C1CC3=CC=C(C=C3)C#N)F)CC(=O)O

InChI

InChI=1S/C21H16FNO2/c1-13-17(10-21(24)25)9-16-6-7-18(22)11-20(16)19(13)8-14-2-4-15(12-23)5-3-14/h2-7,9,11H,8,10H2,1H3,(H,24,25)