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

Systemtic Name: 2-[[2-fluoranyl-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopentene-1,3-dicarboxylic acid Openeye Name: 2-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopentene-1,3-dicarboxylic acid CAS Name: 2-[[2-fluoro-4-(3-methoxyphenyl)anilino]-oxomethyl]cyclopentene-1,3-dicarboxylic acid IUPAC Name: 2-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopentene-1,3-dicarboxylic acid Traditional Name: 2-[[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl]cyclopentene-1,3-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(CCC3C(=O)O)C(=O)O)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3C(=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)18-14(20(25)26)6-7-15(18)21(27)28/h2-5,8-10,14H,6-7H2,1H3,(H,23,24)(H,25,26)(H,27,28)