2-[2,7-bis(oxidanylidene)azepan-1-yl]-6-fluoranyl-benzoic acid

Systemtic Name: 2-[2,7-bis(oxidanylidene)azepan-1-yl]-6-fluoranyl-benzoic acid Openeye Name: 2-(2,7-dioxoazepan-1-yl)-6-fluoro-benzoic acid CAS Name: 2-(2,7-dioxo-1-azepanyl)-6-fluorobenzoic acid IUPAC Name: 2-(2,7-dioxoazepan-1-yl)-6-fluorobenzoic acid Traditional Name: 2-(2,7-diketoazepan-1-yl)-6-fluoro-benzoic acid Formula: C13H12FNO4 MolecularWeight: 265.237083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)C2=C(C(=CC=C2)F)C(=O)O

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)C2=C(C(=CC=C2)F)C(=O)O

InChI

InChI=1S/C13H12FNO4/c14-8-4-3-5-9(12(8)13(18)19)15-10(16)6-1-2-7-11(15)17/h3-5H,1-2,6-7H2,(H,18,19)