7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid

Systemtic Name: 7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid Openeye Name: 7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid CAS Name: 7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid IUPAC Name: 7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-difluoro-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid Traditional Name: 7-[(cyclohexylamino)methyl]-1-cyclopropyl-6,8-difluoro-4-keto-8,8a-dihydroquinoline-3-carboxylic acid Formula: C20H24F2N2O3 MolecularWeight: 378.412966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

C1CCC(CC1)NCC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H24F2N2O3/c21-16-8-13-18(17(22)14(16)9-23-11-4-2-1-3-5-11)24(12-6-7-12)10-15(19(13)25)20(26)27/h8,10-12,17-18,23H,1-7,9H2,(H,26,27)