1-(2,3-dihydro-1H-inden-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1H-inden-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6,8-difluoro-1-indan-1-yl-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-(2,3-dihydro-1H-inden-1-yl)-6,8-difluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1H-inden-1-yl)-6,8-difluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6,8-difluoro-1-indan-1-yl-4-keto-7-piperazino-quinoline-3-carboxylic acid Formula: C23H21F2N3O3 MolecularWeight: 425.427946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1N3C=C(C(=O)C4=CC(=C(C(=C43)F)N5CCNCC5)F)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2C1N3C=C(C(=O)C4=CC(=C(C(=C43)F)N5CCNCC5)F)C(=O)O

InChI

InChI=1S/C23H21F2N3O3/c24-17-11-15-20(19(25)21(17)27-9-7-26-8-10-27)28(12-16(22(15)29)23(30)31)18-6-5-13-3-1-2-4-14(13)18/h1-4,11-12,18,26H,5-10H2,(H,30,31)