3-chloranyl-5-[[(E)-3-(2-fluorophenyl)-2-methyl-prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-chloranyl-5-[[(E)-3-(2-fluorophenyl)-2-methyl-prop-2-enoyl]amino]benzoic acid Openeye Name: 3-chloro-5-[[(E)-3-(2-fluorophenyl)-2-methyl-prop-2-enoyl]amino]benzoic acid CAS Name: 3-chloro-5-[[(E)-3-(2-fluorophenyl)-2-methyl-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-chloro-5-[[(E)-3-(2-fluorophenyl)-2-methylprop-2-enoyl]amino]benzoic acid Traditional Name: 3-chloro-5-[[(E)-3-(2-fluorophenyl)-2-methyl-acryloyl]amino]benzoic acid Formula: C17H13ClFNO3 MolecularWeight: 333.741423

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1F)C(=O)NC2=CC(=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C/C(=C\C1=CC=CC=C1F)/C(=O)NC2=CC(=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C17H13ClFNO3/c1-10(6-11-4-2-3-5-15(11)19)16(21)20-14-8-12(17(22)23)7-13(18)9-14/h2-9H,1H3,(H,20,21)(H,22,23)/b10-6+