2-[(2-fluoranyl-4-methyl-phenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(2-fluoranyl-4-methyl-phenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(2-fluoro-4-methyl-phenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[(2-fluoro-4-methylanilino)-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(2-fluoro-4-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[(2-fluoro-4-methyl-phenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C16H16FNO3 MolecularWeight: 289.301543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3)F

InChI

InChI=1S/C16H16FNO3/c1-8-2-5-12(11(17)6-8)18-15(19)13-9-3-4-10(7-9)14(13)16(20)21/h2-6,9-10,13-14H,7H2,1H3,(H,18,19)(H,20,21)