2-[[(E)-3-(6-fluoranylnaphthalen-2-yl)-2-methyl-prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-(6-fluoranylnaphthalen-2-yl)-2-methyl-prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-(6-fluoro-2-naphthyl)-2-methyl-prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(6-fluoro-2-naphthalenyl)-2-methyl-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(6-fluoronaphthalen-2-yl)-2-methylprop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(6-fluoro-2-naphthyl)-2-methyl-acryloyl]amino]benzoic acid Formula: C21H16FNO3 MolecularWeight: 349.355043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C=C1)C=C(C=C2)F)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C/C(=C\C1=CC2=C(C=C1)C=C(C=C2)F)/C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H16FNO3/c1-13(20(24)23-19-5-3-2-4-18(19)21(25)26)10-14-6-7-16-12-17(22)9-8-15(16)11-14/h2-12H,1H3,(H,23,24)(H,25,26)/b13-10+