ethyl 7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1-prop-1-en-2-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1-prop-1-en-2-yl-quinoline-3-carboxylate Openeye Name: ethyl 7-(cyclohexylamino)-6-fluoro-1-isopropenyl-4-oxo-quinoline-3-carboxylate CAS Name: 7-(cyclohexylamino)-6-fluoro-1-(1-methylethenyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(cyclohexylamino)-6-fluoro-4-oxo-1-prop-1-en-2-ylquinoline-3-carboxylate Traditional Name: 7-(cyclohexylamino)-6-fluoro-1-isopropenyl-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C21H25FN2O3 MolecularWeight: 372.433203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)NC3CCCCC3)C(=C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)NC3CCCCC3)C(=C)C

InChI

InChI=1S/C21H25FN2O3/c1-4-27-21(26)16-12-24(13(2)3)19-11-18(17(22)10-15(19)20(16)25)23-14-8-6-5-7-9-14/h10-12,14,23H,2,4-9H2,1,3H3