4-fluoranyl-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid

Systemtic Name: 4-fluoranyl-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Openeye Name: 4-fluoro-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 4-fluoro-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 4-fluoro-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Traditional Name: 4-fluoro-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C21H16FNO3 MolecularWeight: 349.355043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)F)C(=O)O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)F)C(=O)O)/C2=CC3=CC=CC=C3C=C2

InChI

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