6,8-bis(fluoranyl)-4-oxidanylidene-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6,8-bis(fluoranyl)-4-oxidanylidene-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6,8-difluoro-4-oxo-1-phenyl-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6,8-difluoro-4-oxo-1-phenyl-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6,8-difluoro-4-oxo-1-phenyl-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6,8-difluoro-4-keto-1-phenyl-7-piperazino-quinoline-3-carboxylic acid Formula: C20H17F2N3O3 MolecularWeight: 385.364086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

InChI

InChI=1S/C20H17F2N3O3/c21-15-10-13-17(16(22)18(15)24-8-6-23-7-9-24)25(12-4-2-1-3-5-12)11-14(19(13)26)20(27)28/h1-5,10-11,23H,6-9H2,(H,27,28)