7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1-pentan-3-yl-cinnoline-3-carboxylic acid

Systemtic Name: 7-(cyclohexylamino)-6-fluoranyl-4-oxidanylidene-1-pentan-3-yl-cinnoline-3-carboxylic acid Openeye Name: 7-(cyclohexylamino)-1-(1-ethylpropyl)-6-fluoro-4-oxo-cinnoline-3-carboxylic acid CAS Name: 7-(cyclohexylamino)-6-fluoro-4-oxo-1-pentan-3-yl-3-cinnolinecarboxylic acid IUPAC Name: 7-(cyclohexylamino)-6-fluoro-4-oxo-1-pentan-3-ylcinnoline-3-carboxylic acid Traditional Name: 7-(cyclohexylamino)-1-(1-ethylpropyl)-6-fluoro-4-keto-cinnoline-3-carboxylic acid Formula: C20H26FN3O3 MolecularWeight: 375.437143

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=CC(=C(C=C2C(=O)C(=N1)C(=O)O)F)NC3CCCCC3

Isomeric SMILES

CCC(CC)N1C2=CC(=C(C=C2C(=O)C(=N1)C(=O)O)F)NC3CCCCC3

InChI

InChI=1S/C20H26FN3O3/c1-3-13(4-2)24-17-11-16(22-12-8-6-5-7-9-12)15(21)10-14(17)19(25)18(23-24)20(26)27/h10-13,22H,3-9H2,1-2H3,(H,26,27)