5-fluoranyl-1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl]-5-propyl-azepane-2-carboxylic acid

Systemtic Name: 5-fluoranyl-1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl]-5-propyl-azepane-2-carboxylic acid Openeye Name: 5-fluoro-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-5-propyl-azepane-2-carboxylic acid CAS Name: 5-fluoro-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-5-propyl-2-azepanecarboxylic acid IUPAC Name: 5-fluoro-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl]-5-propylazepane-2-carboxylic acid Traditional Name: 5-fluoro-1-[(2-keto-5-methyl-1,3-dioxol-4-yl)methyl]-5-propyl-azepane-2-carboxylic acid Formula: C15H22FNO5 MolecularWeight: 315.337283

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(N(CC1)CC2=C(OC(=O)O2)C)C(=O)O)F

Isomeric SMILES

CCCC1(CCC(N(CC1)CC2=C(OC(=O)O2)C)C(=O)O)F

InChI

InChI=1S/C15H22FNO5/c1-3-5-15(16)6-4-11(13(18)19)17(8-7-15)9-12-10(2)21-14(20)22-12/h11H,3-9H2,1-2H3,(H,18,19)