3-[[2-fluoranyl-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopent-2-ene-1,2-dicarboxylic acid

Systemtic Name: 3-[[2-fluoranyl-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopent-2-ene-1,2-dicarboxylic acid Openeye Name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopent-2-ene-1,2-dicarboxylic acid CAS Name: 3-[[2-fluoro-4-(3-methoxyphenyl)anilino]-oxomethyl]cyclopent-2-ene-1,2-dicarboxylic acid IUPAC Name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopent-2-ene-1,2-dicarboxylic acid Traditional Name: 3-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopent-2-ene-1,2-dicarboxylic acid Formula: C21H18FNO6 MolecularWeight: 399.369123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(C(CC3)C(=O)O)C(=O)O)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(C(CC3)C(=O)O)C(=O)O)F

InChI

InChI=1S/C21H18FNO6/c1-29-13-4-2-3-11(9-13)12-5-8-17(16(22)10-12)23-19(24)14-6-7-15(20(25)26)18(14)21(27)28/h2-5,8-10,15H,6-7H2,1H3,(H,23,24)(H,25,26)(H,27,28)