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1-cyclopropyl-6-fluoranyl-2-nonan-3-yl-4-oxidanylidene-quinoline-3-carboxylic acid

1-cyclopropyl-6-fluoranyl-2-nonan-3-yl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name:1-cyclopropyl-6-fluoranyl-2-nonan-3-yl-4-oxidanylidene-quinoline-3-carboxylic acid
Openeye Name:1-cyclopropyl-2-(1-ethylheptyl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid
CAS Name:1-cyclopropyl-6-fluoro-2-nonan-3-yl-4-oxo-3-quinolinecarboxylic acid
IUPAC Name:1-cyclopropyl-6-fluoro-2-nonan-3-yl-4-oxoquinoline-3-carboxylic acid
Traditional Name:1-cyclopropyl-2-(1-ethylheptyl)-6-fluoro-4-keto-quinoline-3-carboxylic acid
Formula: C22H28FNO3
MolecularWeight: 373.461023
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)C1=C(C(=O)C2=C(N1C3CC3)C=CC(=C2)F)C(=O)O


Isomeric SMILES

CCCCCCC(CC)C1=C(C(=O)C2=C(N1C3CC3)C=CC(=C2)F)C(=O)O


InChI

InChI=1S/C22H28FNO3/c1-3-5-6-7-8-14(4-2)20-19(22(26)27)21(25)17-13-15(23)9-12-18(17)24(20)16-10-11-16/h9,12-14,16H,3-8,10-11H2,1-2H3,(H,26,27)


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